SCHEMBL131853

SCHEMBL131853

CC(C)c1ccc(N=C=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
TYR P14679 2/20 0.46
TRPA1 O75762 1/20 0.44
CYP2C9 P11712 2/20 0.42
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
GRIN3A Q8TCU5 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
NOS3 P29474 2/20 0.38
NOS1 P29475 2/20 0.38
NOS2 P35228 2/20 0.38

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
SCHEMBL7005068 0.92 CYP3A4 (0.44) CYP3A4TSHRMAPK1TDP1TYR
SCHEMBL21934213 0.89 CYP3A4 (0.71) CYP3A4TSHRMAPK1TDP1TYR
SCHEMBL8674507 0.87 TSHR (0.53) CYP3A4TSHRMAPK1TDP1TYR
Toluene SCHEMBL28374870 0.87 CNR2 (0.41) CYP3A4TSHRMAPK1TDP1TYR
SCHEMBL30295346 0.86 CYP3A4 (0.50) CYP3A4TSHRMAPK1TDP1TYR
SCHEMBL141743 0.86 CYP3A4 (0.50) CYP3A4TSHRMAPK1TDP1TYR
SCHEMBL8093579 0.86 MAPT (0.46) CYP3A4TSHRMAPK1TDP1TYR
SCHEMBL24999153 0.84 MGLL (0.42) CYP3A4TSHRMAPK1TDP1TYR
SCHEMBL10814362 0.83 CYP3A4 (0.47) CYP3A4TSHRMAPK1TDP1TYR
SCHEMBL10328423 0.83 NOS3 (0.50) CYP3A4TSHRMAPK1TDP1TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120081763-A Method and device for continuously preparing isoproturon 江苏快达农化股份有限公司 2025-06-03 CN claimed
CN-119335105-A Method for determining azo dye and isocyanate harmful substances in textile 深圳市艾溹技术研究有限公司 2025-01-21 CN claimed
CN-115960017-B Modified acrylic ester monomer and photo-curable resin thereof 上海华峰龙湾技术有限公司 2024-11-22 CN claimed
CN-118185291-B Light high-strength polyurethane composite material and preparation method thereof 长春三友智造科技发展有限公司 2024-08-27 CN claimed
CN-118185291-A Light high-strength polyurethane composite material and preparation method thereof 长春三友智造科技发展有限公司 2024-06-14 CN claimed
CN-114551885-B Black adhesive for lithium battery aluminum plastic film and use method thereof 上海紫江新材料科技股份有限公司 2024-06-11 CN claimed
CN-117964892-A Modified macromer, preparation method thereof and application thereof in polymer polyol 中国石油化工股份有限公司 2024-05-03 CN claimed
CN-116768764-A Process for preparing urea derivatives 安道麦阿甘有限公司 2023-09-19 CN claimed
CN-116525948-A Method for inhibiting corrosion of aluminum foil of lithium battery current collector based on isocyanate additive 临沂大学 2023-08-01 CN claimed
CN-115960017-A Modified acrylate monomer and photocurable resin thereof 上海华峰龙湾技术有限公司 2023-04-14 CN claimed
EP-1754705-A2 Antagonists for treatment of CD11/CD18 adhesion receptor mediated disorders Genentech, Inc. (US) 2007-02-21 EP claimed
EP-1118644-B1 Hot melt printing ink SIEGWERK DRUCKFARBEN AG (DE) 2006-06-14 EP claimed
WO-2006060082-A1 TRICYCLIC COMPOUNDS, PREPARATION THEREOF AND USE THEREOF AS CHOLINESTERASE ACTIVITY INHIBITORS THE GOVERNMENT OF THE U.S.A. as represented by THE SEC., DEPT. OF HEALTH & HUMAN SERVICES, NATIONAL INSTITUTES OF HEALTH (US) 2006-06-08 WO claimed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
US-6669869-B2 Capable of firmly adhering to an electronic component and a circuit board and achieving good electrical continuity by thermal compression bonding at low temperature at which the circuit board is not eteriorated NITTO DENKO CORPORATION (JP) 2003-12-30 US claimed
US-20030068841-A1 Process of producing semiconductor device and resin composition sheet used therefor NITTO DENKO CORPORATION 2003-04-10 US claimed
US-20020130302-A1 Anisotropic conductive film NITTO DENKO CORPORATION (JP) 2002-09-19 US claimed
EP-1118644-A2 Hot melt printing ink Siegwerk Druckfarben GmbH & Co. KG (DE) 2001-07-25 EP claimed
WO-1998002478-A2 WATER-THINNABLE, SINGLE-COMPONENT EPOXY RESIN SYSTEMS WITH LATENT HARDENING VIANOVA RESINS GMBH (DE) 1998-01-22 WO claimed
US-5073611-A Containing photoreactive compound capable of abstracting hydrogen; coatings, hot melt adhesives BASF AKTIENGESELLSCHAFT (DE) 1991-12-17 US claimed