SCHEMBL398748

SCHEMBL398748

CCc1ccc(Cl)c(CC)c1N

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 0.36
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32
HTT P42858 2/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
CSNK2A3 Q8NEV1 1/20 0.32
POLB P06746 1/20 0.31
NOS3 P29474 1/20 0.31
NOS2 P35228 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
HTR2A P28223 2/20 0.31
CLCN2 P51788 1/20 0.31
SLC6A4 P31645 1/20 0.31
KCNH2 Q12809 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
SCHEMBL30862051 1.00 CTRC (0.36) CTRCGABRA1GABRB2CDK5CDK5R1
SCHEMBL9361882 0.84 TAAR1 (0.34) CDK5CDK5R1GAAPOLBNOS3
SCHEMBL393531 0.81 POLB (0.35) CTRCGABRA1GABRB2HTTPOLB
SCHEMBL3669302 0.80 CYP3A4 (0.35) GAASMN1; SMN2NOS3NOS2TAAR1
SCHEMBL9366157 0.80 CTRC (0.38) CTRCGABRA1GABRB2HTTCSNK2A2
SCHEMBL8089494 0.79 CTRC (0.40) CTRCGABRA1GABRB2SMN1; SMN2CSNK2A2
SCHEMBL10341210 0.78 ATP4A (0.43) CTRCGABRA1GABRB2HTTGAA
SCHEMBL10341195 0.78 CYP3A4 (0.40) GAAPOLBNOS3NOS2TAAR1
SCHEMBL459542 0.77 POLB (0.38) CTRCGABRA1GABRB2HTTPOLB
Ammonia Solution, Strong SCHEMBL233672 0.77 CTRC (0.39) CTRCGABRA1GABRB2SMN1; SMN2CSNK2A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118909588-A Halogen-free flame-retardant low-density polyurethane sealant and preparation method thereof 北京霜辰月科技有限公司 2024-11-08 CN claimed
CN-117701124-B Silane modified polyether waterproof coating and preparation method and application thereof 科顺防水科技股份有限公司 2024-07-09 CN claimed
CN-118165677-A Anti-aging high-toughness acrylic adhesive 创烨新材料(苏州)有限公司 2024-06-11 CN claimed
CN-118165634-A Room-temperature-cured high-toughness cavitation-corrosion-resistant polyurethane coating and preparation method thereof 中国科学院兰州化学物理研究所 2024-06-11 CN claimed
CN-118126330-A Polysilsesquioxane and preparation method and application thereof 华东理工大学 2024-06-04 CN claimed
CN-118048103-A Polyurethane elastomer coating layer for guide wheel and preparation method thereof 乐山高测新能源科技有限公司 2024-05-17 CN claimed
CN-117820841-A Production method of flame-retardant polyurethane sieve plate 安徽屹翔滤材有限公司 2024-04-05 CN claimed
CN-117736573-A Preparation method of low-noise high-wear-resistance polymer elastomer composite material 长春工业大学 2024-03-22 CN claimed
CN-111819215-B Curable epoxy system 亨斯迈先进材料美国有限责任公司 2024-03-19 CN claimed
CN-117701124-A Silane modified polyether waterproof coating and preparation method and application thereof 科顺防水科技股份有限公司 2024-03-15 CN claimed
EP-1037933-B1 POLYURETHANE AND POLYURETHANE/UREA HEAT-CURED AND MOISTURE-CURED ELASTOMERS WITH IMPROVED PHYSICAL PROPERTIES BAYER AG (DE) 2002-03-20 EP claimed
EP-1037933-A1 POLYURETHANE AND POLYURETHANE/UREA HEAT-CURED AND MOISTURE-CURED ELASTOMERS WITH IMPROVED PHYSICAL PROPERTIES BAYER AG (DE) 2000-09-27 EP claimed
EP-0868455-B1 ELASTOMERIC POLYURETHANES WITH IMPROVED PROPERTIES BASED ON CRYSTALLIZABLE POLYOLS IN COMBINATION WITH LOW MONOL POLYOXYPROPYLENE POLYOLS ARCO CHEM TECH (US) 2000-05-10 EP claimed
US-5962617-A OPTICAL CLARITY, HEAT AND CHEMICAL RESISTANT SIMULA INC. (US) 1999-10-05 US claimed
WO-1999029752-A1 POLYURETHANE AND POLYURETHANE/UREA HEAT-CURED AND MOISTURE-CURED ELASTOMERS WITH IMPROVED PHYSICAL PROPERTIES BAYER AG (DE) 1999-06-17 WO claimed
EP-0677072-B1 ROOM TEMPERATURE CURABLE SILANE-TERMINATED POLYURETHANE DISPERSIONS MINNESOTA MINING & MFG (US) 1999-03-10 EP claimed
EP-0868455-A1 ELASTOMERIC POLYURETHANES WITH IMPROVED PROPERTIES BASED ON CRYSTALLIZABLE POLYOLS IN COMBINATION WITH LOW MONOL POLYOXYPROPYLENE POLYOLS ARCO Chemical Technology, L.P. (US) 1998-10-07 EP claimed
CN-1156462-A High temperature polyurethane/urea elastomer GATES RUBBER CO (US) 1997-08-06 CN claimed
WO-1997023531-A1 ELASTOMERIC POLYURETHANES WITH IMPROVED PROPERTIES BASED ON CRYSTALLIZABLE POLYOLS IN COMBINATION WITH LOW MONOL POLYOXYPROPYLENE POLYOLS ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1997-07-03 WO claimed
EP-0544266-B1 Process for the preparation of bismaleimides LONZA AG (CH) 1996-09-25 EP claimed