SCHEMBL2801431

SCHEMBL2801431

CCC(C)CC(C)(CC)CC

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL1874134 0.87 TSHR (0.31) TSHR
SCHEMBL17607677 0.85
SCHEMBL12554309 0.85
SCHEMBL22296082 0.85
SCHEMBL13755873 0.85
SCHEMBL21592374 0.79
SCHEMBL15280590 0.79
SCHEMBL19509521 0.78
SCHEMBL1020494 0.78 TSHR (0.42) TSHR
SCHEMBL19497731 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023038488-A1 COMPOSITION FOR FORMING FILM, AND FILM FORMED THEREFROM 주식회사 헤라켐테크놀러지 2023-03-16 WO disclosed
EP-3837317-A1 CROSSLINKABLE ORGANOSILOXANE COMPOSITIONS Wacker Chemie AG (DE) 2021-06-23 EP disclosed
WO-2020035149-A1 CROSSLINKABLE ORGANOYSILOXANE COMPOSITIONS WACKER CHEMIE AG (DE) 2020-02-20 WO disclosed
US-8796269-B2 Crystalline 2-(3,5-Bis(trifluoromethyl)phenyl)-N-(4-(4-fluoro-2-methylphenyl)-6-((7S,9aS)-7-(hydroxymethyl)hexahydropyrazino[2,1-c][1,4]oxazin-8(1H)-yl)pyridin-3-yl)-N,2-dimethyl-propanamide of the formula (I), their use in therapy, and process for the preparation of the same NERRE THERAPEUTICS LIMITED (GB) 2014-08-05 US disclosed
EP-2470545-B1 ANHYDRATE FORMS OF A PYRIDINE DERIVATIVE NERRE THERAPEUTICS LTD (GB) 2013-10-09 EP disclosed
US-8440775-B2 Curable liquid composition, method of coating, inorganic substrate, and semiconductor device DOW CORNING CORPORATION (US) 2013-05-14 US disclosed
CN-101600755-B Curable liquid composition, coating method, inorganic substrate and semiconductor device DOW CORNING TORAY CO LTD JP 2012-08-08 CN disclosed
US-8236564-B2 Automated titration method for use on blended asphalts UNIVERSITY OF WYOMING RESEARCH CORPORATION (US) 2012-08-07 US disclosed
US-20120157450-A1 Anhydrate Forms Of A Pyridine Derivative KaNDy Therapeutics Limited (GB) 2012-06-21 US disclosed
US-20100251935-A1 Blended Asphaltic Composition UNIVERSITY OF WYOMING RESEARCH CORPORATION D/B/A WESTERN RESEARCH INSTITUTE (US) 2010-10-07 US disclosed
WO-2008099767-A2 CURABLE LIQUID COMPOSITION, METHOD OF COATING, INORGANIC SUBSTRATE, AND SEMICONDUCTOR DEVICE DOW CORNING TORAY CO., LTD. (JP) 2008-08-21 WO disclosed
US-20040058451-A1 Automated flocculation titrimeter system WESTERN RESEARCH INSTITUTE, INC. 2004-03-25 US disclosed
EP-1393063-A1 AUTOMATED FLOCCULATION TITRIMETER SYSTEM UNIVERSITY OF WYOMING RESEARCH CORPORATION, doing business as, WESTERN RESEARCH INSTITUTE (US) 2004-03-03 EP disclosed
WO-2002063292-A1 AUTOMATED FLOCCULATION TITRIMETER SYSTEM THE UNIVERSITY OF WYOMING RESEARCH CORPORATION (US) 2002-08-15 WO disclosed
EP-0826009-A4 BIMODAL, CROSSLINKED TONER RESIN AND PROCESS FOR MAKING SAME IMAGE POLYMERS COMPANY (US) 1998-12-02 EP disclosed
EP-0826009-A1 BIMODAL, CROSSLINKED TONER RESIN AND PROCESS FOR MAKING SAME Image Polymers Company (US) 1998-03-04 EP disclosed
WO-1996036652-A1 BIMODAL, CROSSLINKED TONER RESIN AND PROCESS FOR MAKING SAME IMAGE POLYMERS COMPANY (US) 1996-11-21 WO disclosed
US-4650905-A PRE- AND POSTEMERGENCE HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1987-03-17 US disclosed
EP-0116167-B1 DIPHENYLETHERS, PROCESS FOR THEIR PREPARATION AND THEIR USE IN COMBATTING WEEDS BASF Aktiengesellschaft (DE) 1986-02-26 EP disclosed
EP-0116167-A1 Diphenylethers, process for their preparation and their use in combatting weeds BASF Aktiengesellschaft (DE) 1984-08-22 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 (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-20120157450-A1 Anhydrate Forms Of A Pyridine Derivative CA4, CA2, CA7 TSHR 1850/4885TDP1 4156/4885

“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.