SCHEMBL17183733

SCHEMBL17183733

C=CC(CCCCCCCC)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.41
CSNK1E P49674 1/20 0.41
OPRM1 P35372 2/20 0.40
OPRD1 P41143 2/20 0.40
OPRK1 P41145 2/20 0.40
OPRL1 P41146 2/20 0.40
NAAA Q02083 2/20 0.40
SIGMAR1 Q99720 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
ASAH1 Q13510 2/20 0.38
KCNH2 Q12809 1/20 0.38
SLC2A1 P11166 1/20 0.37
CYP19A1 P11511 3/20 0.37
ALDH1A1 P00352 2/20 0.37
ACER2 Q5QJU3 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11896274 1.00 HTR2A (0.41) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL27608809 1.00 HTR2A (0.41) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL17183756 1.00 HTR2A (0.41) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL17183791 1.00 HTR2A (0.41) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL17183673 1.00 HTR2A (0.41) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL17183731 1.00 HTR2A (0.41) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL4635969 0.98 SIGMAR1 (0.41) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL4819524 0.93 POLB (0.41) HTR2AOPRM1OPRD1OPRK1OPRL1
SCHEMBL788448 0.86 HTR2A (0.40) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL3022300 0.85 AOC3 (0.42) HTR2ASIGMAR1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11492432-B2 Resin for nanoimprinting, laminate containing resin for nanoimprinting, printed board containing resin for nanoimprinting, and method for producing nanoimprint substrate JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2022-11-08 US disclosed
US-11078381-B2 Catechol-containing adhesive hydrogel, composition for preparing adhesive hydrogel, and compositions each including said adhesive hydrogel JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2021-08-03 US disclosed
US-11015010-B2 Block copolymer comprising catechol segment and inorganic nanoparticles coated by said block copolymer, as well as method for producing block copolymer comprising catechol segment and method for producing inorganic nanoparticles coated by said block copolymer JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2021-05-25 US disclosed
US-10851237-B2 Block copolymer, multilayered structure, solid polymer membrane, fuel cell, method for producing multilayered structure, and method for producing multilayered structure including inorganic nanoparticles JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2020-12-01 US disclosed
EP-3305866-B1 CATECHOL-CONTAINING ADHESIVE HYDROGEL, COMPOSITION FOR PREPARING ADHESIVE HYDROGEL, AND COMPOSITIONS EACH INCLUDING SAID ADHESIVE HYDROGEL JAPAN SCIENCE & TECH AGENCY (JP) 2020-07-29 EP disclosed
US-20200223125-A1 RESIN FOR NANOIMPRINTING, LAMINATE CONTAINING RESIN FOR NANOIMPRINTING, PRINTED BOARD CONTAINING RESIN FOR NANOIMPRINTING, AND METHOD FOR PRODUCING NANOIMPRINT SUBSTRATE JAPAN SCIENCE & TECH AGENCY (JP) 2020-07-16 US disclosed
US-20200190362-A1 CATECHOL-CONTAINING ADHESIVE HYDROGEL, COMPOSITION FOR PREPARING ADHESIVE HYDROGEL, AND COMPOSITIONS EACH INCLUDING SAID ADHESIVE HYDROGEL JAPAN SCIENCE & TECH AGENCY (JP) 2020-06-18 US disclosed
US-10611927-B2 Catechol-containing adhesive hydrogel, composition for preparing adhesive hydrogel, and compositions each including said adhesive hydrogel JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2020-04-07 US disclosed
US-20190169420-A1 BLOCK COPOLYMER, MULTILAYER STRUCTURE, SOLID POLYMER FILM, FUEL CELL, PRODUCTION METHOD FOR MULTILAYER STRUCTURE, AND PRODUCTION METHOD FOR MULTILAYER STRUCTURE CONTAINING INORGANIC NANOPARTICLES JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2019-06-06 US disclosed
US-20180118978-A1 CATECHOL-CONTAINING ADHESIVE HYDROGEL, COMPOSITION FOR PREPARING ADHESIVE HYDROGEL, AND COMPOSITIONS EACH INCLUDING SAID ADHESIVE HYDROGEL JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2018-05-03 US disclosed
EP-3305866-A1 CATECHOL-CONTAINING ADHESIVE HYDROGEL, COMPOSITION FOR PREPARING ADHESIVE HYDROGEL, AND COMPOSITIONS EACH INCLUDING SAID ADHESIVE HYDROGEL Japan Science And Technology Agency (JP) 2018-04-11 EP disclosed
EP-3112387-B1 BLOCK COPOLYMER CONTAINING CATECHOL SEGMENT, INORGANIC NANOPARTICLES COATED BY SAID BLOCK COPOLYMER, METHOD FOR PRODUCING BLOCK COPOLYMER CONTAINING CATECHOL SEGMENT, AND METHOD FOR PRODUCING INORGANIC NANOPARTICLES COATED BY SAID BLOCK COPOLYMER JAPAN SCIENCE & TECH AGENCY (JP) 2018-04-04 EP disclosed
US-20170008993-A1 BLOCK COPOLYMER COMPRISING CATECHOL ,SEGMENT AND INORGANIC NANOPARTICLES COATED BY SAID BLOCK COPOLYMER, AS WELL AS METHOD FOR PRODUCING BLOCK COPOLYMER COMPRISING CATECHOL, SEGMENT AND METHOD FOR PRODUCING INORGANIC NANOPARTICLES COATED BY SAID BLOCK COPOLYMER JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2017-01-12 US disclosed
EP-3112387-A1 BLOCK COPOLYMER CONTAINING CATECHOL SEGMENT, INORGANIC NANOPARTICLES COATED BY SAID BLOCK COPOLYMER, METHOD FOR PRODUCING BLOCK COPOLYMER CONTAINING CATECHOL SEGMENT, AND METHOD FOR PRODUCING INORGANIC NANOPARTICLES COATED BY SAID BLOCK COPOLYMER Japan Science and Technology Agency (JP) 2017-01-04 EP disclosed
US-20150298387-A1 RESIN FOR NANOIMPRINTING, LAMINATE CONTAINING RESIN FOR NANOIMPRINTING, PRINTED BOARD CONTAINING RESIN FOR NANOIMPRINTING, AND METHOD FOR PRODUCING NANOIMPRINT SUBSTRATE JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2015-10-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180118978-A1 CATECHOL-CONTAINING ADHESIVE HYDROGEL, COMPOSITION FOR PREPARING ADHESIVE HYDROGEL, AND COMPOSITIONS EACH INCLUDING SAID ADHESIVE HYDROGEL CDH1, CD44, COMT HTR2A 622/4885CSNK1E 4169/4885OPRM1 1518/4885
US-20200190362-A1 CATECHOL-CONTAINING ADHESIVE HYDROGEL, COMPOSITION FOR PREPARING ADHESIVE HYDROGEL, AND COMPOSITIONS EACH INCLUDING SAID ADHESIVE HYDROGEL CDH1, CD44, COMT HTR2A 622/4885CSNK1E 4169/4885OPRM1 1518/4885
US-11078381-B2 Catechol-containing adhesive hydrogel, composition for preparing adhesive hydrogel, and compositions each including said adhesive hydrogel CDH1, CD44, COMT HTR2A 622/4885CSNK1E 4169/4885OPRM1 1518/4885
US-10611927-B2 Catechol-containing adhesive hydrogel, composition for preparing adhesive hydrogel, and compositions each including said adhesive hydrogel CDH1, CD44, COMT HTR2A 622/4885CSNK1E 4169/4885OPRM1 1518/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.