SCHEMBL241534

SCHEMBL241534

O=C=Nc1ccc(-c2ccc(N=C=O)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.61
TSHR P16473 1/20 0.61
TDP1 Q9NUW8 3/20 0.50
MAPK1 P28482 1/20 0.50
TRPA1 O75762 1/20 0.46
CYP1A2 P05177 1/20 0.42
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
MEN1 O00255 1/20 0.33
APP P05067 1/20 0.33
THRB P10828 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
P2RY6 Q15077 1/20 0.32
MIF P14174 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
SCHEMBL23721668 1.00 CYP3A4 (0.61) CYP3A4TSHRTDP1MAPK1TRPA1
Hydrogen Sulfide SCHEMBL3894665 0.97 CYP3A4 (0.58) CYP3A4TSHRTDP1MAPK1TRPA1
Water SCHEMBL3898007 0.97 CYP3A4 (0.58) CYP3A4TSHRTDP1MAPK1TRPA1
SCHEMBL2114610 0.92 CYP3A4 (0.54) CYP3A4TSHRTDP1MAPK1TRPA1
SCHEMBL15430 0.91 CYP3A4 (0.70) CYP3A4TSHRTDP1MAPK1TRPA1
Propane SCHEMBL4897787 0.90 CYP3A4 (0.58) CYP3A4TSHRTDP1MAPK1TRPA1
Propane SCHEMBL9799774 0.90 CYP3A4 (0.58) CYP3A4TSHRTDP1MAPK1TRPA1
SCHEMBL139997 0.90 CYP3A4 (0.52) CYP3A4TSHRTDP1MAPK1TRPA1
SCHEMBL21993321 0.90 CYP3A4 (0.52) CYP3A4TSHRTDP1MAPK1TRPA1
SCHEMBL7585383 0.88 CYP3A4 (0.50) CYP3A4TSHRTDP1MAPK1TRPA1

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 3489 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250243313-A1 POLYCAPROLACTONE POLYOLS, ELASTOMERS, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2025-07-31 US claimed
US-20250230274-A1 POLYCAPROLACTONE POLYOLS, POLYURETHANE DISPERSIONS, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2025-07-17 US claimed
EP-3953407-B1 2-COMPONENT POLYURETHANE COATINGS WITH IMPROVED POT LIFE WITHOUT LOST WEATHERING STABILITY COVESTRO DEUTSCHLAND AG (DE) 2025-04-30 EP claimed
EP-4058499-B1 POLYSILOXANE FUNCTIONALIZED POLYURETHANES FOR ENHANCING HYDROPHOBISATION OF SURFACES COVESTRO DEUTSCHLAND AG (DE) 2024-12-04 EP claimed
US-20240332628-A1 Silicon-Based Energy Storage Devices With Electrolyte Containing Cyanate Based Compounds ENEVATE CORP (US) 2024-10-03 US claimed
US-20240287363-A1 POLYCAPROLACTONE POLYOLS, POLYURETHANES, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2024-08-29 US claimed
EP-4401634-A1 BIOACTIVE RELEASING MEMBRANE FOR ANALYTE SENSOR Dexcom, Inc. (US) 2024-07-24 EP claimed
US-20240132796-A1 TRIBOLOGICAL SYSTEM KLUEBER LUBRICATION MUENCHEN SE & CO. KG (DE) 2024-04-25 US claimed
CN-117751150-A Process for preparing alkoxylated polyphenol mixtures and use of said mixtures 索普瑞玛公司 2024-03-22 CN claimed
US-11905483-B2 Tribological system KLUEBER LUBRICATION MUENCHEN SE & CO. KG (DE) 2024-02-20 US claimed
EP-0109744-B1 UV CURABLE COMPOSITION AND COATINGS WESTINGHOUSE ELECTRIC CORPORATION (US) 1988-01-07 EP claimed
EP-0152049-A2 Process for the preparation of thermoplastic polyurethane elastomers and their use BAYER AG (DE) 1985-08-21 EP claimed
US-4369302-A Curable resin composition comprising cyanate ester and polyisocyanate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-01-18 US claimed
US-4328325-A Process for the preparation of polymers containing urethane groups WACKER CHEMIE GMBH (DE) 1982-05-04 US claimed
EP-0033181-A1 Mixtures of branched-chain amines and derivatives thereof AKZO N.V. (NL) 1981-08-05 EP claimed
US-4178277-A Modified polyesters DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) 1979-12-11 US claimed
US-4107151-A FROM POLYISOCYANATE, CHAIN POLYOL, AROMATIC DIAMINE, POLYOL OR AMINO ALCOHOL WITH URETHANE BOND IHARA CHEMICAL COMPANY CO., LTD. (JP) 1978-08-15 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-4096291-A HYDROXYL COMPOUNDS AND BLOCKED POLYISOCYANATES; CROSSLINKING BAYER AKTIENGESELLSCHAFT (DT) 1978-06-20 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