SCHEMBL166652

SCHEMBL166652

CCOc1ccc(N=C=O)cc1N=C=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.54
TRPA1 O75762 1/20 0.54
TDP1 Q9NUW8 2/20 0.41
MAPK1 P28482 2/20 0.41
ALDH1A1 P00352 3/20 0.40
HPGD P15428 3/20 0.40
TSHR P16473 4/20 0.39
CHUK O15111 1/20 0.38
DAPK3 O43293 1/20 0.38
JAK2 O60674 1/20 0.38
ROCK2 O75116 1/20 0.38
PRKCG P05129 1/20 0.38
CDK1 P06493 1/20 0.38
PIM1 P11309 1/20 0.38
RPS6KB1 P23443 1/20 0.38
CDK2 P24941 1/20 0.38
AKT1 P31749 1/20 0.38
AKT2 P31751 1/20 0.38
MAPKAPK2 P49137 1/20 0.38
BLK P51451 1/20 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
SCHEMBL29703185 1.00 CYP3A4 (0.54) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL6153230 0.91 TDP1 (0.49) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL9576009 0.87 CYP3A4 (0.51) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL10827257 0.86 CYP3A4 (0.44) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL29510772 0.86 CHUK (0.51) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL908852 0.86 CHUK (0.51) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL11660774 0.84 MAPK1 (0.42) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL6721254 0.83 KDM4E (0.44) CYP3A4TDP1ALDH1A1HPGDTSHR
SCHEMBL10583983 0.83 CYP3A4 (0.50) CYP3A4TRPA1TDP1MAPK1ALDH1A1
SCHEMBL542562 0.82 CYP3A4 (0.43) CYP3A4TRPA1TDP1MAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12448476-B2 Multi(meth)acrylate-functionalized oligomers and methods of preparing and using such oligomers ARKEMA FRANCE (FR) 2025-10-21 US claimed
CN-117279972-A Two-component polyurethane compositions, methods of making, and methods of using the same 阿科玛法国 2023-12-22 CN claimed
EP-4263209-A1 A TWO-COMPONENT POLYURETHANE COMPOSITION, PROCESS FOR PREPARING THE SAME AND A METHOD OF USE THEREOF ARKEMA FRANCE (FR) 2023-10-25 EP claimed
CN-113811555-B Urethane (meth) acrylate, neutralized product thereof, photocurable resin composition, and liquid composition 根上工业株式会社 2023-03-10 CN claimed
US-20220396652-A1 MULTI(METH)ACRYLATE-FUNCTIONALIZED OLIGOMERS AND METHODS OF PREPARING AND USING SUCH OLIGOMERS ARKEMA FRANCE (FR) 2022-12-15 US claimed
WO-2022133025-A1 A TWO-COMPONENT POLYURETHANE COMPOSITION, PROCESS FOR PREPARING THE SAME AND A METHOD OF USE THEREOF ASHLAND LICENSING AND INTELLECTUAL PROPERTY LLC (US) 2022-06-23 WO claimed
CN-114630852-A Poly (meth) acrylate functionalized oligomers and methods of making and using such oligomers 阿科玛法国公司 2022-06-14 CN claimed
US-20210369911-A1 HYDROGEL COMPOSITIONS UNIVERSITÉ DE HAUTE-ALSACE (FR) 2021-12-02 US claimed
EP-3861042-A1 HYDROGEL COMPOSITIONS Ophtalmic Compagnie (FR) 2021-08-11 EP claimed
WO-2020070422-A1 HYDROGEL COMPOSITIONS OPHTALMIC COMPAGNIE (FR) 2020-04-09 WO claimed
US-20050049356-A1 Tire with indicia THE GOODYEAR TIRE & RUBBER COMPANY 2005-03-03 US claimed
US-6838407-B2 Room temperature curable fluoropolymer coating LORD CORPORATION (US) 2005-01-04 US claimed
US-6709758-B2 SOLUTION OF CARBOXYLATED HYDROGENATED NITRILE/DIENE/ACID COPOLYMER AND AN ISOCYANATE CONTAINING ANOTHER CROSSLINKING GROUP, ESPECIALLY ANOTHER ISOCYANATE OR A TRIALKOXYSILANE GROUP LORD CORPORATION 2004-03-23 US claimed
US-20040048082-A1 Room temperature curable X-HNBR coating LORD CORPORATION 2004-03-11 US claimed
US-20030152790-A1 Room temperature curable functionalized HNBR coating LORD CORPORATION 2003-08-14 US claimed
US-20030105218-A1 Room temperature curable oil resistant elastomer coating LORD CORPORATION 2003-06-05 US claimed
US-20030104213-A1 Room temperature curable fluoropolymer coating LORD CORPORATION 2003-06-05 US claimed
US-5998510-A POLYESTERURETHANE COPOLYMER PREMIX, INC. (US) 1999-12-07 US claimed
US-5134189-A Isocyanate, Imino Compound, Polymeric Binder MITSUBISHI PAPER MILLS LIMITED (JP) 1992-07-28 US claimed
US-4321350-A Process for the catalytic setting of polyurethane molding compositions GAMBRO DIALYSATOREN KG (DE) 1982-03-23 US claimed