SCHEMBL126346

SCHEMBL126346

CC(Cc1ccc(N=C=O)cc1)c1ccc(N=C=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.55
TSHR P16473 2/20 0.55
ESR1 P03372 2/20 0.52
ESR2 Q92731 1/20 0.52
CYP1A2 P05177 1/20 0.41
TRPA1 O75762 1/20 0.37
PTGS1 P23219 4/20 0.36
PTGS2 P35354 4/20 0.36
CYP2C9 P11712 3/20 0.36
LMNA P02545 2/20 0.36
AKR1C3 P42330 2/20 0.36
CXCR1 P25024 2/20 0.36
CXCR2 P25025 2/20 0.36
ALB P02768 1/20 0.36
ALOX5 P09917 1/20 0.36
RARB P10826 1/20 0.36
ADRB3 P13945 1/20 0.36
NFKB1 P19838 1/20 0.36
HTR2A P28223 1/20 0.36
NR1I3 Q14994 1/20 0.36

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
SCHEMBL28470740 0.92 CYP3A4 (0.46) CYP3A4TSHRESR1ESR2ALOX5
SCHEMBL16387619 0.83 CYP3A4 (0.61) CYP3A4TSHRESR1CYP1A2TRPA1
SCHEMBL1041021 0.83 TSHR (0.61) CYP3A4TSHRESR1CYP1A2TRPA1
SCHEMBL17320579 0.81 CYP3A4 (0.59) CYP3A4TSHRESR1ESR2CYP1A2
SCHEMBL3842072 0.81 CYP2C9 (0.49) CYP3A4TSHRCYP1A2TRPA1CYP2C9
SCHEMBL10856743 0.80 CYP3A4 (0.47) CYP3A4TSHRCYP1A2TRPA1PTGS1
SCHEMBL21934213 0.79 CYP3A4 (0.71) CYP3A4TSHRCYP1A2TRPA1CYP2C9
SCHEMBL9181988 0.79 CYP3A4 (0.46) CYP3A4TSHRCYP1A2TRPA1CYP2C9
SCHEMBL12804676 0.79 CYP3A4 (0.55) CYP3A4TSHRCYP1A2TRPA1HTR2A
SCHEMBL13788270 0.78 CYP3A4 (0.59) CYP3A4TSHRESR1ESR2CYP1A2

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

Claimed or disclosed in 83 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
WO-2022133025-A1 A TWO-COMPONENT POLYURETHANE COMPOSITION, PROCESS FOR PREPARING THE SAME AND A METHOD OF USE THEREOF ASHLAND LICENSING AND INTELLECTUAL PROPERTY LLC (US) 2022-06-23 WO claimed
US-20240052090-A1 A TWO-COMPONENT POLYURETHANE COMPOSITION, PROCESS FOR PREPARING THE SAME AND A METHOD OF USE THEREOF ARKEMA FRANCE (FR) 2024-02-15 US disclosed
EP-3589671-B1 MULTI-COMPONENT ADHESIVE SYSTEM ARKEMA FRANCE (FR) 2023-12-13 EP disclosed
EP-4063449-B1 THERMOPLASTIC VULCANIZATES COMPRISING ACRYLATE RUBBER AND THERMOPLASTIC POLYURETHANE PARKER HANNIFIN CORP (US) 2023-12-13 EP disclosed
EP-4063448-B1 THERMOPLASTIC VULCANIZATES MADE OF THERMOPLASTIC POLYURETHANE AND CARBOXYLATED NITRILE BUTADIENE PARKER HANNIFIN CORP (US) 2023-12-06 EP disclosed
US-20220306855-A1 THERMOPLASTIC VULCANIZATES COMPRISING ACRYLATE RUBBER AND THERMOPLASTIC POLYURETHANE PARKER-HANNIFIN CORPORATION 2022-09-29 US disclosed
US-20220306860-A1 THERMOPLASTIC VULCANIZATES COMPRISING CARBOXYLATED NITRILE RUBBER AND THERMOPLASTIC POLYURETHANE PARKER-HANNIFIN CORPORATION 2022-09-29 US disclosed
WO-2018160535-A1 MULTI-COMPONENT ADHESIVE SYSTEM HERCULES LLC (US) 2018-09-07 WO disclosed
EP-2277721-B1 Method of encapsulating an electronic tire tag and device BRIDGESTONE FIRESTONE NORTH AM (US) 2013-10-30 EP disclosed
EP-2277720-B1 Method of encapsulating an electronic tire tag and device BRIDGESTONE FIRESTONE NORTH AM (US) 2013-07-17 EP disclosed
EP-0343764-A2 Thickened moulding resin composition GENCORP INC. (US) 1989-11-29 EP disclosed
US-4876308-A FIBERGLASS REINFORCED PLASTICS WITH GOOD HUMIDITY ADHESION GENCORP INC. (US) 1989-10-24 US disclosed
US-4868231-A IN SITU FORMATION OF POLYUREAS, UNSATURATED POLYESTER GENCORP INC. (US) 1989-09-19 US disclosed
EP-0328808-A2 Polyurethane adhesive for a surface treatment-free fiber reinforced plastic GENCORP INC. (US) 1989-08-23 EP disclosed
EP-0102720-B1 POLYURETHANE COATING OR ADHESIVE COMPOSITIONS AND METHODS OF USING THEM ROHM AND HAAS COMPANY (US) 1988-07-13 EP disclosed
EP-0102720-A1 Polyurethane coating or adhesive compositions and methods of using them ROHM AND HAAS COMPANY (US) 1984-03-14 EP disclosed
US-4426510-A Polyurethane preparation using organo-zinc catalyst and time-lapse modifier ROHM AND HAAS COMPANY (US) 1984-01-17 US disclosed
US-4341875-A High flexural modulus reaction injection molded urethanes OLIN CORPORATION (US) 1982-07-27 US disclosed
US-4223145-A THERMAL DECOMPOSITION OF HYDROCHLORIDE OF TRISUBSTITUTED UREA AKZO N.V. (NL) 1980-09-16 US disclosed