SCHEMBL57779

SCHEMBL57779

Cc1c(C)c(N=C=O)c(C)c(C)c1N=C=O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.46
GABRA1 P14867 1/20 0.42
GABRB2 P47870 1/20 0.42
TRPA1 O75762 1/20 0.34
TSHR P16473 1/20 0.33
CASP1 P29466 1/20 0.33

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
SCHEMBL7747680 0.97 CYP3A4 (0.44) CYP3A4GABRA1GABRB2TRPA1TSHR
SCHEMBL28344084 0.94 CYP3A4 (0.42) CYP3A4GABRA1GABRB2TRPA1TSHR
SCHEMBL2835593 0.93 CYP3A4 (0.46) CYP3A4GABRA1GABRB2TRPA1TSHR
SCHEMBL2814949 0.90 CYP3A4 (0.44) CYP3A4GABRA1GABRB2TRPA1TSHR
SCHEMBL112221 0.88 CYP3A4 (0.42) CYP3A4GABRA1GABRB2TRPA1TSHR
SCHEMBL28795111 0.88 CYP3A4 (0.42) CYP3A4GABRA1GABRB2TRPA1TSHR
SCHEMBL18126140 0.87 CYP3A4 (0.38) CYP3A4GABRA1GABRB2
SCHEMBL11042791 0.84 GABRA1 (0.39) CYP3A4GABRA1GABRB2TSHR
SCHEMBL3764897 0.83 GABRA1 (0.47) CYP3A4GABRA1GABRB2
SCHEMBL5427471 0.81 CYP3A4 (0.43) CYP3A4GABRA1GABRB2TRPA1

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 1561 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4253497-B1 POLYURETHANE COMPOSITION HAVING REDUCED FOAMING AND MATTE EFFECT SIKA TECH AG (CH) 2025-10-01 EP claimed
WO-2025082321-A1 MOLD-PROOF POLYURETHANE COMPOSITION, AND PREPARATION METHOD THEREFOR AND USE THEREOF SIKA技术股份公司 2025-04-24 WO claimed
US-12121864-B2 Flexibly adaptable membrane cartridges for the separation of fluids EVONIK OPERATIONS GMBH (DE) 2024-10-22 US claimed
CN-118725717-A One-component coating composition, coating system, and coated article 宣伟(南通)涂料有限公司 2024-10-01 CN claimed
WO-2024133274-A1 COMPONENT FOR LUBRICANTS CARL BECHEM GMBH (DE) 2024-06-27 WO claimed
US-20230392059-A1 POLYURETHANE COMPOSITION HAVING REDUCED BLISTERING AND MATTE EFFECT SIKA TECHNOLOGY AG (CH) 2023-12-07 US claimed
EP-4253497-A1 POLYURETHANE COMPOSITION HAVING REDUCED FOAMING AND MATTE EFFECT Sika Technology AG (CH) 2023-10-04 EP claimed
CN-112898939-B Primer-free fast curing polyurethane compositions with low total VOC content SIKA技术股份公司 2023-04-28 CN claimed
US-20230017467-A1 A POLYURETHANE COMPOSITION HAVING LOW TOTAL VOC CONTENT CAPABLE OF RAPID CURING WITH NO NEED OF PRIMER SIKA TECHNOLOGY AG (CH) 2023-01-19 US claimed
CN-112375530-B Polyurethane composition with reduced foaming and matte effect SIKA技术股份公司 2022-10-28 CN claimed
US-20100021743-A1 ASYMMETRIC DIALDIMINE-CONTAINING POLYURETHANE COMPOSITION SIKA TECHNOLOGY AG (CH) 2010-01-28 US claimed
EP-2139936-A1 ASYMMETRIC DIALDIMINE-CONTAINING POLYURETHANE COMPOSITION Sika Technology AG (CH) 2010-01-06 EP claimed
WO-2008116902-A1 ASYMMETRIC DIALDIMINE-CONTAINING POLYURETHANE COMPOSITION SIKA TECHNOLOGY AG (CH) 2008-10-02 WO claimed
EP-1975189-A1 Polyurethane compound containing asymmetric dialdimine Sika Technology AG (CH) 2008-10-01 EP claimed
US-20080090973-A1 Polyester polyols, a process for the production thereof and the use thereof BAYER MATERIALSCIENCE AG (DE) 2008-04-17 US claimed
US-20070238849-A1 Durene isocyanate-based elastomers for golf ball layer compositions ACUSHNET COMPANY 2007-10-11 US claimed
US-6784219-B2 PARTICULARLY USEFUL FOR THE PRODUCTION OF MOLDINGS EXPOSED TO HIGH MECHANICAL STRESSES. BAYER AKTIENGESELLSCHAFT (DE) 2004-08-31 US claimed
US-20030135008-A1 Polyurethane cast elastomers based on durene diisocyanate BAYER AKTIENGESELLSCHAFT (DE) 2003-07-17 US claimed
US-6486346-B1 Process for the preparation of durene diisocyanate BAYER AKTIENGESELLSCHAFT (DE) 2002-11-26 US claimed
EP-0033181-A1 Mixtures of branched-chain amines and derivatives thereof AKZO N.V. (NL) 1981-08-05 EP claimed