SCHEMBL211654

SCHEMBL211654

O=C=Nc1ccc(Cc2ccccc2)c(N=C=O)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.50
TSHR P16473 1/20 0.50
TRPA1 O75762 1/20 0.49
CYP1A2 P05177 1/20 0.42
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CTRC Q99895 3/20 0.38
BCL2 P10415 1/20 0.38
BCL2L1 Q07817 1/20 0.38
ALOX5 P09917 1/20 0.38
PTPN1 P18031 2/20 0.36
PTPN2 P17706 1/20 0.36
PTPN6 P29350 1/20 0.36
CYP2C9 P11712 1/20 0.35
ELANE P08246 1/20 0.35

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
SCHEMBL29975843 1.00 CYP3A4 (0.50) CYP3A4TSHRTRPA1CYP1A2MAPK1
SCHEMBL108775 0.90 CYP3A4 (0.63) CYP3A4TSHRTRPA1CYP1A2MAPK1
SCHEMBL374838 0.86 CYP3A4 (0.58) CYP3A4TSHRTRPA1CYP1A2MAPK1
SCHEMBL8418041 0.86 CYP3A4 (0.47) CYP3A4TSHRTRPA1CYP1A2MAPK1
SCHEMBL1130659 0.84 CYP3A4 (0.56) CYP3A4TSHRTRPA1CYP1A2MAPK1
SCHEMBL10713858 0.84 CYP3A4 (0.50) CYP3A4TSHRTRPA1CYP1A2MAPK1
SCHEMBL1396327 0.84 CYP3A4 (0.56) CYP3A4TSHRTRPA1CYP1A2MAPK1
SCHEMBL11204931 0.83 CYP3A4 (0.43) CYP3A4TSHRTRPA1TDP1BCL2
SCHEMBL1396400 0.82 CYP3A4 (0.67) CYP3A4TSHRTRPA1CYP1A2MAPK1
Toluene Diisocyanate SCHEMBL6135590 0.81 CYP3A4 (0.73) CYP3A4TSHRTRPA1CYP1A2MAPK1

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 1451 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118354902-A Moisture curable adhesive composition 阿科玛法国 2024-07-16 CN claimed
CN-117160239-A Ceramic filter element and method of forming a filter membrane module 纳诺斯通沃特公司 2023-12-05 CN claimed
CN-115160536-B High-voltage cable terminal sealing method 国网上海市电力公司 2023-09-12 CN claimed
CN-116728934-A Multilayer polyurethane shock pad and manufacturing thereof 巴斯夫欧洲公司 2023-09-12 CN claimed
CN-113195078-B Diaphragm with reinforced potting material 纳诺斯通沃特公司 2023-08-29 CN claimed
CN-116554802-A Organic silicon polyester composite adhesive tape and production method thereof 江西欣美新材料科技有限公司 2023-08-08 CN claimed
CN-112601644-B Method for producing thermoformable polymer/fiber composite materials 巴斯夫欧洲公司 2023-07-18 CN claimed
CN-115340841-B Polyurethane hot melt adhesive for bonding automobile exterior trim parts and preparation method thereof 北京高盟新材料股份有限公司 2023-06-30 CN claimed
CN-116285832-A Intelligent solidification type bi-component solvent-free polyurethane adhesive and preparation method thereof 南通高盟新材料有限公司 2023-06-23 CN claimed
CN-115322726-B Low-density polyurethane hot melt adhesive and preparation method thereof 北京高盟新材料股份有限公司 2023-06-09 CN claimed
US-6376637-B1 USING BRANCHED POLYISOCYANATES BASF CORPORATION 2002-04-23 US claimed
US-6251988-B1 SOLUTION IN ORGANIC SOLVENT BAYER AKTIENGESELLSCHAFT (DE) 2001-06-26 US claimed
EP-0442084-B1 Two-component polyurethane adhesive MILES INC (US) 1994-02-16 EP claimed
EP-0152049-A2 Process for the preparation of thermoplastic polyurethane elastomers and their use BAYER AG (DE) 1985-08-21 EP claimed
EP-0062184-B1 WEATHER-PROOF COVERING FOR WALL PANELS BAYER AG (DE) 1984-12-19 EP claimed
EP-0062184-A1 Weather-proof covering for wall panels BAYER AG (DE) 1982-10-13 EP claimed
US-4237250-A Polyurethanes containing aryl sulfonic acid alkyl ester groups BAYER AKTIENGESELLSCHAFT (DE) 1980-12-02 US claimed
EP-0013391-A1 Process for the preparation of modified polyisocyanates, polyisocyanates obtained by this process and their use as reaction components in the preparation of polyurethane plastics BAYER AG (DE) 1980-07-23 EP claimed
US-4087407-A Process for the production of epoxy silicate foam BLOUNT DAVID H 1978-05-02 US claimed
US-4021414-A Sulfuric acid-resistant polyurethane composition and method of preparation THE GOODYEAR TIRE & RUBBER COMPANY (US) 1977-05-03 US claimed