SCHEMBL109084

SCHEMBL109084

Cc1cc(N=C=O)cc(N=C=O)c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.48
TRPA1 O75762 1/20 0.48
TDP1 Q9NUW8 2/20 0.41
MAPK1 P28482 1/20 0.41
TSHR P16473 1/20 0.39
CYP1A2 P05177 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
ERN1 O75460 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
SCHEMBL59852 0.95 CYP3A4 (0.48) CYP3A4TRPA1TDP1MAPK1TSHR
Benzene SCHEMBL28982643 0.90 CYP3A4 (0.45) CYP3A4TRPA1TDP1MAPK1TSHR
SCHEMBL7002811 0.88 CYP3A4 (0.44) CYP3A4TRPA1TDP1MAPK1TSHR
SCHEMBL131042 0.86 TDP1 (0.50) CYP3A4TRPA1TDP1MAPK1TSHR
SCHEMBL5444503 0.84 MAPK1 (0.44) CYP3A4TRPA1TDP1MAPK1TSHR
SCHEMBL4240933 0.84 CYP3A4 (0.41) CYP3A4TRPA1TDP1MAPK1TSHR
SCHEMBL740126 0.83 CYP3A4 (0.40) CYP3A4TRPA1TDP1MAPK1TSHR
SCHEMBL29664620 0.83 CYP3A4 (0.40) CYP3A4TRPA1TDP1MAPK1TSHR
SCHEMBL11097683 0.82 CYP3A4 (0.71) CYP3A4TRPA1TDP1MAPK1TSHR
SCHEMBL13768440 0.81 CYP3A4 (0.39) CYP3A4TRPA1TDP1MAPK1TSHR

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

Appears in 2073 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120020195-A Dual-curing adhesive system for syringe needle cementing, preparation method and application thereof 中国石油化工股份有限公司 2025-05-20 CN claimed
CN-118406427-B High-wear-resistance water-based elastic coating 宁波彩格新材料科技有限公司 2025-05-02 CN claimed
CN-118530646-B Wear-resistant pipeline powder and preparation method thereof 宁波博士盾纳米新材料科技有限公司 2025-05-02 CN claimed
CN-119640427-A Polypropylene short fiber for low-foam filtration and preparation method thereof 江苏博韬新材料有限公司 2025-03-18 CN claimed
CN-118792007-B Hot melt adhesive for automotive interiors and preparation method thereof 广东雅乔新材料有限公司 2025-03-07 CN claimed
WO-2024259956-A1 PREPARATION METHOD FOR POSITIVE ELECTRODE SHEET, POSITIVE ELECTRODE SHEET, BATTERY CELL, BATTERY AND ELECTRICAL DEVICE 宁德时代新能源科技股份有限公司 2024-12-26 WO claimed
CN-119181803-A Preparation method of positive electrode plate, battery monomer, battery and electricity utilization device 宁德时代新能源科技股份有限公司 2024-12-24 CN claimed
CN-119081626-A Flame-retardant polyurethane composite material and preparation method thereof 丽水学院 2024-12-06 CN claimed
CN-118908643-A Premixed concrete for building and preparation method thereof 宁波杭州湾新区浦东混凝土有限公司 2024-11-08 CN claimed
CN-116442572-B Manufacturing method of mobile phone optical film 深圳市中佑光学科技有限公司 2024-10-22 CN claimed
US-4211699-A FROM A DIISOCYANATE, AN AMINO- OR HYDRAZINO DIOL, AND A MASKING LACTAM BAYER AKTIENGESELLSCHAFT (DE) 1980-07-08 US claimed
US-4174434-A POLYETHER SURFACTANT, POLYURETHANES, FIREPROOF AND SOLVENT RESISTANT BAYER AKTIENGESELLSCHAFT (DE) 1979-11-13 US claimed
US-4153775-A DIHYDROXY MASKED DIISOCYANATE BAYER AKTIENGESELLSCHAFT (DE) 1979-05-08 US claimed
US-4119582-A POLYALKYLENE ETHER POLYOL CONTAINING VINYL POLYMER, DIPHENYLMETHANE DIISOCYANATE, SILOXANE-OXYALKYLENE COPOLYMER SURFACTANT MITSUI-NISSO CORPORATION (JP) 1978-10-10 US claimed
US-4100118-A POLYGLYCIDYL ESTER OF A FATTY ACID, ISOCYANATE COMPOUND AND CURING CATALYST, THERMAL RESISTANCE, THERMAL SHOCK RESISTANCE HITACHI, LTD. (JP) 1978-07-11 US claimed
US-4086211-A Method of producing polyurethane products having an improved flex crack resistance BRIDGESTONE TIRE COMPANY LIMITED (JA) 1978-04-25 US claimed
US-4062825-A SILICA BRIDGESTONE TIRE COMPANY, LTD. (JA) 1977-12-13 US claimed
US-3996223-A Process for the production of polyisocyanates of isocyanurate structure BAYER AKTIENGESELLSCHAFT (DT) 1976-12-07 US claimed
US-3963681-A POLYETHERURETHANE COPOLYMERS BRIDGESTONE TIRE COMPANY LIMITED (JA) 1976-06-15 US claimed
US-3937673-A DIELECTRICS PHELPS DODGE INDUSTRIES, INC. (US) 1976-02-10 US claimed