SCHEMBL124245

SCHEMBL124245

COc1ccc(N=C=O)cc1N=C=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.59
TRPA1 O75762 1/20 0.59
ALDH1A1 P00352 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
HPGD P15428 1/20 0.56
MAPK1 P28482 2/20 0.44
TSHR P16473 4/20 0.38
PTGS1 P23219 2/20 0.38
PTGS2 P35354 2/20 0.38
HTR3E A5X5Y0 1/20 0.38
HTR3B O95264 1/20 0.38
HTR3A P46098 1/20 0.38
HTR3D Q70Z44 1/20 0.38
HTR3C Q8WXA8 1/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL29510769 1.00 CYP3A4 (0.59) CYP3A4TRPA1ALDH1A1TDP1HPGD
SCHEMBL9776922 0.93 CYP3A4 (0.63) CYP3A4TRPA1ALDH1A1TDP1HPGD
SCHEMBL11748612 0.91 MAPK1 (0.53) CYP3A4TRPA1ALDH1A1TDP1HPGD
SCHEMBL9359157 0.89 CYP3A4 (0.49) CYP3A4TRPA1ALDH1A1TDP1HPGD
SCHEMBL29800238 0.85 CYP3A4 (0.71) CYP3A4TRPA1ALDH1A1TDP1HPGD
SCHEMBL543088 0.85 CYP3A4 (0.71) CYP3A4TRPA1ALDH1A1TDP1HPGD
SCHEMBL29600721 0.85 HTR3E (0.53) CYP3A4TRPA1ALDH1A1TDP1HPGD
SCHEMBL307695 0.85 HTR3E (0.53) CYP3A4TRPA1ALDH1A1TDP1HPGD
SCHEMBL5891689 0.83 CYP3A4 (0.73) CYP3A4TRPA1ALDH1A1TDP1HPGD
SCHEMBL1019299 0.81 CYP3A4 (0.56) CYP3A4TRPA1ALDH1A1TDP1HPGD

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 3200 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

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
US-12343905-B2 Method for producing cycloolefin resin-decorative molded article RIMTEC CORPORATION (JP) 2025-07-01 US claimed
CN-118307737-A Degradable and recyclable polyether polyurethane and preparation method thereof 华南理工大学 2024-07-09 CN 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-111788244-B rigid foam 伊科尼克技术有限公司 2023-09-15 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
EP-3538611-B1 POLYURETHANE COMPRISING GRAPHENE NANO STRUCTURE BASF SE (DE) 2023-08-02 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-11530292-B2 Polyurethane comprising graphene nano structure BASF SE 2022-12-20 US claimed
US-5344484-A Decorative door skin MASONITE CORPORATION (US) 1994-09-06 US claimed
EP-0548256-A4 BIOSTABLE POLYURETHANE PRODUCTS 1993-07-07 EP claimed
EP-0548256-A1 BIOSTABLE POLYURETHANE PRODUCTS PolyMedica Industries, Inc. (US) 1993-06-30 EP claimed
US-5134189-A Isocyanate, Imino Compound, Polymeric Binder MITSUBISHI PAPER MILLS LIMITED (JP) 1992-07-28 US claimed
WO-1992004390-A1 BIOSTABLE POLYURETHANE PRODUCTS POLYMEDICA INDUSTRIES, INC. (US) 1992-03-19 WO claimed
US-4849262-A Pigment printing pastes and dyeing liquors containing stable dispersions of finely divided solid polyisocyanates BASF AKTIENGESELLSCHAFT (DE) 1989-07-18 US claimed
US-4560617-A FERROMAGNETIC PARTICLES AND RADIATION POLYMERIZABLE RESIN BINDER TDK CORPORATION (JP) 1985-12-24 US claimed
US-4321350-A Process for the catalytic setting of polyurethane molding compositions GAMBRO DIALYSATOREN KG (DE) 1982-03-23 US claimed
US-4028310-A REACTING POLYISOCYANATES WITH DIAMINES, COATINGS BAYER AKTIENGESELLSCHAFT (DT) 1977-06-07 US claimed
US-3937673-A DIELECTRICS PHELPS DODGE INDUSTRIES, INC. (US) 1976-02-10 US claimed