SCHEMBL455310

SCHEMBL455310

CCCCCC/C=C/c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.50
EGFR P00533 1/20 0.49
SOAT2 O75908 1/20 0.47
SOAT1 P35610 1/20 0.47
SIGMAR1 Q99720 2/20 0.47
FAAH O00519 2/20 0.45
EPHX2 P34913 2/20 0.45
CYSLTR2 Q9NS75 2/20 0.45
CYSLTR1 Q9Y271 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
HTR2A P28223 3/20 0.44
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43

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
SCHEMBL29828 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL10625168 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL9172117 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL6905623 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL2168403 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL363637 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL7796983 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL465270 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL6903530 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL2555594 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1

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 76 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023044460-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING HYDROXYMELONAL FORMATE ESTER P2 SCIENCE, INC. (US) 2023-03-23 WO 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-10907116-B2 Olfactive compositions comprising cyclohexyl-alkyl carbinols P2 SCIENCE, INC. (US) 2021-02-02 US disclosed
EP-3492066-B1 COSMETIC PREPARATIONS HAVING A CALMING EFFECT BEIERSDORF AG (DE) 2020-10-14 EP disclosed
EP-3247691-B1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NEOPENTYL GLYCOL DIACETATE P2 SCIENCE INC (US) 2020-09-16 EP 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
EP-3492066-A1 COSMETIC PREPARATIONS HAVING A CALMING EFFECT Beiersdorf AG (DE) 2019-06-05 EP disclosed
EP-2654686-B1 COSMETIC PREPARATIONS HAVING A CALMING EFFECT BEIERSDORF AG (DE) 2019-01-16 EP disclosed
EP-3414309-A1 FRAGRANCE COMPOSITIONS COMPRISING COMPOUNDS WITH OLFACTORY QUALITIES P2 Science, Inc. (US) 2018-12-19 EP disclosed
US-20180346844-A1 FRAGRANCE COMPOSITIONS COMPRISING COMPOUNDS WITH OLFACTORY QUALITIES P2 SCIENCE, INC. 2018-12-06 US disclosed
WO-1997046504-A1 MIXTURES CONTAINING MONOMERS AND STABILIZERS BASF AKTIENGESELLSCHAFT (DE) 1997-12-11 WO disclosed
US-5466838-A Catalytic reaction of olefin with oxygen in the presence of aldehyde SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-11-14 US disclosed
EP-0540009-B1 Process for producing epoxides SUMITOMO CHEMICAL CO (JP) 1995-08-30 EP disclosed
US-5367087-A Process for producing epoxide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-11-22 US disclosed
EP-0540009-A1 Process for producing epoxides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-05-05 EP disclosed
US-4868225-A STERICALLY HINDERED META-PHENYLENEDIAMINE CHAIN EXTENDER FOR POLYURETHANES THE DOW CHEMICAL COMPANY (US) 1989-09-19 US disclosed
US-4861742-A Bifunctional alkali metal compounds, preparation and use thereof as polymerization initiators BASF AKTIENGESELLSCHAFT (DE) 1989-08-29 US disclosed
US-4792623-A CURING AGENT, EXTENDER THE DOW CHEMICAL COMPANY (US) 1988-12-20 US disclosed
EP-0082258-B1 SUBSTITUTED M-PHENYLENEDIAMINES THE DOW CHEMICAL COMPANY (US) 1986-02-19 EP disclosed
EP-0082258-A1 Substituted m-phenylenediamines THE DOW CHEMICAL COMPANY (US) 1983-06-29 EP 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 (3 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-20200190362-A1 CATECHOL-CONTAINING ADHESIVE HYDROGEL, COMPOSITION FOR PREPARING ADHESIVE HYDROGEL, AND COMPOSITIONS EACH INCLUDING SAID ADHESIVE HYDROGEL CDH1, CD44, COMT TNNC1 847/4885EGFR 4436/4885SOAT2 2328/4885
US-11078381-B2 Catechol-containing adhesive hydrogel, composition for preparing adhesive hydrogel, and compositions each including said adhesive hydrogel CDH1, CD44, COMT TNNC1 847/4885EGFR 4436/4885SOAT2 2328/4885
US-10907116-B2 Olfactive compositions comprising cyclohexyl-alkyl carbinols ACMSD, TAS2R1, MINK1 TNNC1 3832/4885EGFR 2498/4885SOAT2 1129/4885

“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.