SCHEMBL27873

SCHEMBL27873

O=C=Nc1cccc(N=C=O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.54
MAPK1 P28482 1/20 0.54
CYP3A4 P08684 4/20 0.50
TRPA1 O75762 1/20 0.50
TSHR P16473 1/20 0.46
GABRA1 P14867 1/20 0.43
GABRB2 P47870 1/20 0.43
CYP1A2 P05177 1/20 0.37
NOS1 P29475 1/20 0.37
MIF P14174 1/20 0.35
ALDH1A1 P00352 3/20 0.33
HPGD P15428 1/20 0.33
CA12 O43570 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL10615043 1.00 TDP1 (0.54) TDP1MAPK1CYP3A4TRPA1TSHR
SCHEMBL27621561 0.97 TDP1 (0.52) TDP1MAPK1CYP3A4TRPA1TSHR
Ethylene SCHEMBL10425506 0.95 TDP1 (0.50) TDP1MAPK1CYP3A4TRPA1TSHR
Benzene SCHEMBL28141723 0.91 MAPK1 (0.47) TDP1MAPK1CYP3A4TRPA1TSHR
SCHEMBL11918198 0.91 TDP1 (0.47) TDP1MAPK1CYP3A4TRPA1TSHR
SCHEMBL671741 0.89 CYP3A4 (0.54) TDP1MAPK1CYP3A4TRPA1TSHR
SCHEMBL26938975 0.89 MAPK1 (0.45) TDP1MAPK1CYP3A4TRPA1TSHR
SCHEMBL894324 0.87 TDP1 (0.48) TDP1MAPK1CYP3A4TRPA1TSHR
SCHEMBL30365208 0.87 TDP1 (0.48) TDP1MAPK1CYP3A4TRPA1TSHR
Butanedione SCHEMBL28856352 0.87 CYP3A4 (0.46) TDP1MAPK1CYP3A4TRPA1TSHR

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 32422 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260146217-A1 LAUNDRY CARE ADDITIVE PARTICLES THE PROCTER & GAMBLE COMPANY (US) 2026-05-28 US claimed
WO-2026104690-A1 AQUEOUS DISPERSION OF A CROSSLINKING COMPONENT FOR CATIONIC PAINT BINDERS ALLNEX AUSTRIA GMBH (AT) 2026-05-21 WO claimed
CN-122038005-A New energy automobile electric compressor insulating lubricating oil and preparation method thereof 广州卡士德汽车用品有限公司 2026-05-15 CN claimed
EP-4739724-A1 MULTI-COMPONENT RESIN SYSTEM COMPRISING AT LEAST ONE PLASTICISER, MORTAR COMPOSITION BASED ON ISOCYANATE-AMINE ADDUCTS, AND METHOD AND USE OF THE MULTI-COMPONENT RESIN SYSTEM FOR FASTENING CONSTRUCTION ELEMENTS Hilti Aktiengesellschaft (LI) 2026-05-13 EP claimed
EP-4739723-A1 MULTI-COMPONENT RESIN SYSTEM COMPRISING AT LEAST ONE MONOALCOHOL, MORTAR COMPOSITION BASED ON ISOCYANATE-AMINE ADDUCTS, AND METHOD AND USE OF THE MULTI-COMPONENT RESIN SYSTEM FOR FASTENING CONSTRUCTION ELEMENTS Hilti Aktiengesellschaft (LI) 2026-05-13 EP claimed
US-20260092174-A1 COMPOSITION FOR FORMING ECO-FRIENDLY POLYURETHANE FOAM HAVING IMPROVED INSULATION PROPERTIES AND METHOD FOR PREPARING POLYURETHANE FOAM SAMYANG CORPORATION (KR) 2026-04-02 US claimed
EP-3643732-B1 COMPOSITION FOR FORMING ENVIRONMENTALLY FRIENDLY POLYURETHANE FOAM AND METHOD FOR MANUFACTURING POLYURETHANE FOAM SAMYANG CORP (KR) 2026-04-01 EP claimed
US-20260071153-A1 TREATMENT COMPOSITION WITH CHITOSAN-BASED DELIVERY PARTICLES ENCAPSYS, LLC (US) 2026-03-12 US claimed
EP-4326795-B1 POLYMERIZATION OF A SILANE-MODIFIED POLYMER, WHICH IS PRODUCED BY MEANS OF A RADICAL CHAIN POLYMERIZATION, IN A POLYOL OR IN A PREPOLYMER WITH TERMINAL ISOCYANATE GROUPS, AND USE THEREOF IN POLYURETHANE FORMULATIONS FOLLMANN GMBH & CO KG (DE) 2026-02-25 EP claimed
US-12552920-B2 Environmentally friendly impregnation systems for fiber surface treatment and preparation methods thereof and an impregnation treatment method BEIJING UNIVERSITY OF CHEMICAL TECHNOLOGY (CN) 2026-02-17 US claimed
US-4036906-A NONHYDROLYZING THE GOODYEAR TIRE & RUBBER COMPANY (US) 1977-07-19 US claimed
US-4028310-A REACTING POLYISOCYANATES WITH DIAMINES, COATINGS BAYER AKTIENGESELLSCHAFT (DT) 1977-06-07 US claimed
US-4002584-A LONG CHAIN POLYOL, HALOGENATED AROMATIC DIAMINE, ONE-SHOT REACTION IHARA CHEMICAL KOGYO KABUSHIKI KAISHA (JA) 1977-01-11 US claimed
US-3997592-A Preparation of aqueous dispersions of blocked aromatic polyisocyanates E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-12-14 US claimed
US-3966683-A Process for the preparation of compounds which contain hydantoin groups BAYER AKTIENGESELLSCHAFT (DT) 1976-06-29 US claimed
US-3962094-A HOLLOW FIBER SEPARATORY DEVICE THE DOW CHEMICAL COMPANY (US) 1976-06-08 US claimed
US-3939122-A Process for the preparation of compounds which contain hydantoin rings BAYER AKTIENGESELLSCHAFT (DT) 1976-02-17 US claimed
US-3937673-A DIELECTRICS PHELPS DODGE INDUSTRIES, INC. (US) 1976-02-10 US claimed
US-3933677-A Preparation of aqueous dispersions of blocked aromatic polyisocyanates E. I. DU PONT DE NEMOURS & COMPANY (US) 1976-01-20 US claimed
US-3931117-A Coating powders for protective films based on ε-caprolactam-blocked isocyanates COOK PAINT AND VARNISH COMPANY (US) 1976-01-06 US claimed