SCHEMBL1010512

SCHEMBL1010512

CCCN(CCC)CC(C)O

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
KCNA5 P22460 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 2/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 2/20 0.33
CA12 O43570 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
HSD17B10 Q99714 1/20 0.33
RECQL P46063 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ATM Q13315 1/20 0.33
CYP51A1 Q16850 1/20 0.32
MEN1 O00255 1/20 0.31
FDPS P14324 1/20 0.31
CA1 P00915 1/20 0.31

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
SCHEMBL18427267 0.95 TSHR (0.36) TSHRKCNA5KDM4EALDH1A1RAB9A
SCHEMBL19774701 0.95 TSHR (0.36) TSHRKCNA5KDM4EALDH1A1RAB9A
SCHEMBL98701 0.94 TSHR (0.40) TSHRKCNA5KDM4EALDH1A1RAB9A
SCHEMBL27387042 0.91 KDM4E (0.40) TSHRKCNA5KDM4EALDH1A1KMT2A
SCHEMBL20996691 0.91 KDM4E (0.34) TSHRKCNA5KDM4EALDH1A1RAB9A
SCHEMBL9640527 0.90 TSHR (0.36) TSHRKCNA5KDM4EKMT2ACA12
SCHEMBL15833657 0.90 TSHR (0.36) TSHRKCNA5KDM4EKMT2ACA12
SCHEMBL21531904 0.89 TSHR (0.32) TSHRKCNA5KDM4EALDH1A1RAB9A
SCHEMBL2058390 0.87 TSHR (0.35) TSHRKCNA5KDM4EKMT2ACA12
SCHEMBL20996681 0.87 ALDH1A1 (0.35) TSHRKCNA5KDM4EALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110396693-A Etchant and engraving method and manufacture display device or method for semiconductor containing IGZO using it DAXIN MATERIALS CORP 2019-11-01 CN claimed
US-20150367277-A1 Alkanolamine-Based Carbon Dioxide Absorbent Containing Polyalkylene Glycol Monomethyl Ether, and Carbon Dioxide Absorption Method and Separation Method Using Same UNIVERSITY-INDUSTRY COOPERATION FOUNDATION OF KYUNG HEE UNIVERSITY (KR) 2015-12-24 US claimed
US-4016115-A Unsaturated polyester resin composition containing titanium dioxide TOYO BOSEKI KABUSHIKI KAISHA (JA) 1977-04-05 US claimed
CN-108779419-B Cleaning agent composition for electronic material, cleaning agent stock solution, and method for cleaning electronic material 荒川化学工业株式会社 2021-04-20 CN disclosed
WO-2021001727-A1 SOLUTION PROCESSABLE METAL-ORGANIC FRAMEWORKS VIA SURFACE FUNCTIONALIZATION KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2021-01-07 WO disclosed
US-20200384115-A1 TARGETED DELIVERY TO BETA CELLS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-12-10 US disclosed
EP-3612232-A1 TARGETED DELIVERY TO BETA CELLS The Broad Institute, Inc. (US) 2020-02-26 EP disclosed
CN-110396693-A Etchant and engraving method and manufacture display device or method for semiconductor containing IGZO using it DAXIN MATERIALS CORP 2019-11-01 CN disclosed
WO-2018195486-A1 TARGETED DELIVERY TO BETA CELLS THE BROAD INSTITUTE, INC. (US) 2018-10-25 WO disclosed
EP-2204394-B1 PROCESS FOR PRODUCTION OF POLYESTER-CONTAINING FLEXIBLE POLYURETHANE FOAM, AND CATALYST COMPOSITION FOR USE IN THE PROCESS TOSOH CORP (JP) 2017-07-12 EP disclosed
US-20150367277-A1 Alkanolamine-Based Carbon Dioxide Absorbent Containing Polyalkylene Glycol Monomethyl Ether, and Carbon Dioxide Absorption Method and Separation Method Using Same UNIVERSITY-INDUSTRY COOPERATION FOUNDATION OF KYUNG HEE UNIVERSITY (KR) 2015-12-24 US disclosed
US-4561000-A METHINE-TYPE CHROMOGEN, BENZOQUINONE OXIDIZER, COLOR PRODUCTION SENSITIVITY REGULATOR, SUBSTRATE MITSUI TOATSU CHEMICALS, INC. (JP) 1985-12-24 US disclosed
EP-0058430-B1 DYESTUFF-CONTAINING MICROSCOPIC CAPSULE DISPERSION FOR RECORD MATERIALS MITSUI TOATSU CHEMICALS, Inc. (JP) 1985-12-04 EP disclosed
EP-0133182-A1 OXIDATION-REDUCTION COLOR PRODUCTION-TYPE HEAT-SENSITIVE RECORDING UNIT MITSUI TOATSU CHEMICALS, Inc. (JP) 1985-02-20 EP disclosed
US-4398753-A METHINE-TYPE DYES AND QUINONE DERIVATIVE IN REDOX SYSTEM FOR CARBON-FREE REPRODUCTION MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1983-08-16 US disclosed
US-4384871-A Dyestuff-containing microscopic capsule dispersion for record materials MITSUI TOATSU CHEMICALS, INC. (JP) 1983-05-24 US disclosed
EP-0058430-A1 Dyestuff-containing microscopic capsule dispersion for record materials MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-08-25 EP disclosed
EP-0055847-A1 Pressure sensitive recording unit MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-07-14 EP disclosed
US-4102824-A DIALKYL ALKANOL AMINE SALT OF ALKYL BENZENESULFONIC ACID, SURFACTANT, ORGANIC SOLVENT KAO SOAP CO., LTD. (JP) 1978-07-25 US disclosed
US-4016115-A Unsaturated polyester resin composition containing titanium dioxide TOYO BOSEKI KABUSHIKI KAISHA (JA) 1977-04-05 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 (1 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-20200384115-A1 TARGETED DELIVERY TO BETA CELLS IAPP, ZFR, ZC3H11A TSHR 3001/4885KCNA5 3993/4885KDM4E 1462/4885

“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.