SCHEMBL38584

SCHEMBL38584

O=C=Nc1ccc2ccccc2c1N=C=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.41
ALDH1A1 P00352 4/20 0.41
HSD17B10 Q99714 4/20 0.41
CYP2A6 P11509 1/20 0.41
TSHR P16473 1/20 0.41
CYP3A4 P08684 2/20 0.40
CYP1A2 P05177 2/20 0.40
HPGD P15428 2/20 0.40
ABCB11 O95342 1/20 0.40
NR3C1 P04150 1/20 0.40
ADRA2A P08913 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
ALOX15 P16050 1/20 0.40
ADRA2C P18825 1/20 0.40
MAOA P21397 1/20 0.40
DRD1 P21728 1/20 0.40
SLC6A4 P31645 1/20 0.40
HTR2B P41595 1/20 0.40
CCR2 P41597 1/20 0.40
HPRT1 P00492 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
SCHEMBL29500990 1.00 TDP1 (0.41) TDP1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL2546296 0.92 PDE3B (0.35) TDP1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL5095517 0.91 HPRT1 (0.48) TDP1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL7159188 0.87 SENP2 (0.35) TDP1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL11881605 0.85 CYP1A2 (0.31) TDP1ALDH1A1HSD17B10CYP3A4CYP1A2
SCHEMBL48435 0.84 ALDH1A1 (0.36) TDP1ALDH1A1HSD17B10CYP3A4CYP1A2
SCHEMBL17787466 0.82 ALDH1A1 (0.42) TDP1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL29642615 0.82 ALDH1A1 (0.42) TDP1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL28080025 0.81 SENP2 (0.44) TDP1ALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL6395774 0.80 ERN1 (0.51) TDP1ALDH1A1HSD17B10CYP2A6TSHR

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 27572 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119591828-B Wet polyurethane resin, wet synthetic leather bass and preparation method and application thereof ZHEJIANG HUAFON SYNTHETIC RESIN Co.,Ltd. (CN) 2026-05-26 CN claimed
CN-122080354-A Polyurethane hard foam, preparation method thereof and refrigerator 2026-05-26 CN claimed
WO-2026104544-A1 EXO-VINYLENE CARBONATE COMPOUNDS AS PRECURSORS FOR ISOCYANATE-FREE URETHANE-TYPE POLYMERS BASF SE (DE) 2026-05-21 WO claimed
EP-4745119-A1 ISOCYANATE COMPOSITION Hanwha Solutions Corporation (KR) 2026-05-20 EP claimed
EP-4745170-A1 METHOD FOR PREPARING A URETHANE GROUP-CONTAINING POLYMER BASF SE (DE) 2026-05-20 EP claimed
EP-4745169-A1 COMPOSITION USEFUL AS COATING, SEALANT OR ADHESIVE BASF SE (DE) 2026-05-20 EP claimed
CN-122060161-A Water-soluble PI, PI composite cellulose, semi-solid electrolyte membrane and preparation method 桂林奇宏科技有限公司 2026-05-19 CN claimed
CN-122037115-A Polyurethane hard foam, preparation method thereof and refrigerator TCL家用电器(合肥)有限公司 2026-05-15 CN claimed
WO-2026055875-A9 ONE-COMPONENT (1K) HEAT-ACTIVATABLE WATERBORNE POLYURETHANE ADHESIVE AND USE THEREOF HENKEL AG & CO. KGAA (DE) 2026-05-15 WO claimed
CN-122037118-A Multi-hydrogen bond polydiurea elastomer and preparation method thereof 南开大学 2026-05-15 CN claimed
US-4248938-A BONDING TO INSURE SOFTNESS AND RESISTANCE TO FATIGUE TEIJIN LIMITED (JP) 1981-02-03 US claimed
EP-0019349-A1 Stabilizing composition for polyarylene esters, stabilized polyarylene ester, moulded article produced therefrom and process for stabilizing a polyarylene ester MONSANTO COMPANY (US) 1980-11-26 EP claimed
US-4222932-A MOLDING MATERIALS STABILIZED BY ADDING AN AROMATIC ISOCYANATE AND AN ALIPHATIC PHOSPHITE MONSANTO COMPANY (US) 1980-09-16 US claimed
US-4208399-A Tolyl isocyanate test antigens, methods for their preparation and use in detecting diisocyanates and antibodies to diisocyanates THE UNIVERSITY OF PITTSBURGH (US) 1980-06-17 US claimed
EP-0009756-A1 Activated isocyanate prepolymers and method for the manufacture of elastomeric polyurethanes BAYER AG (DE) 1980-04-16 EP claimed
US-4185718-A CASTABLE LIQUID CURABLE TO POLYURETHANE BBA GROUP LIMITED (GB) 1980-01-29 US claimed
US-4093759-A Glass container coated with polyurethane TOYO INK MANUFACTURING CO., LTD. (JA) 1978-06-06 US claimed
US-4087414-A Process for producing a flame retardant isocyanurate resin MITSUBISHI GAS CHEMICAL COMPANY, INC. (JA) 1978-05-02 US claimed
US-4057535-A POLYURETHANE LIPATOVA TATYANA ESPEROVNA 1977-11-08 US claimed
US-4026833-A CROSSLINKED FOAMS UNIVERSITY OF NOTRE DAME (US) 1977-05-31 US claimed