SCHEMBL109502

SCHEMBL109502

Cc1c(N=C=O)c(N=C=O)cc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.47
TRPA1 O75762 1/20 0.39
MAPT P10636 2/20 0.38
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
RAD52 P43351 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
CYP1A2 P05177 6/20 0.36
CYP2A6 P11509 3/20 0.36
TSHR P16473 1/20 0.36
ALDH1A1 P00352 8/20 0.35
KDM4E B2RXH2 2/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 5/20 0.33
TDP1 Q9NUW8 2/20 0.33
HSD17B10 Q99714 4/20 0.33
ABCB11 O95342 1/20 0.33
NR3C1 P04150 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
SCHEMBL28535587 0.86 CYP3A4 (0.50) CYP3A4TRPA1MAPTPOLBPKM
SCHEMBL112471 0.84 POLB (0.41) CYP3A4TRPA1MAPTPOLBPKM
SCHEMBL9824695 0.79 CYP3A4 (0.50) CYP3A4TRPA1MAPTGABRA1GABRB2
SCHEMBL17473106 0.78 CYP1A2 (0.40) CYP3A4TRPA1MAPTPOLBPKM
SCHEMBL9824751 0.78 CYP3A4 (0.50) CYP3A4TRPA1MAPTGABRA1GABRB2
SCHEMBL3333505 0.77 CYP3A4 (0.57) CYP3A4TRPA1MAPTCYP1A2CYP2A6
SCHEMBL3713908 0.76 ALDH1A1 (0.42) CYP3A4MAPTPOLBPKMRAD52
SCHEMBL664224 0.76 CYP3A4 (0.46) CYP3A4TRPA1MAPTGABRA1GABRB2
SCHEMBL1901555 0.76 CYP1A2 (0.41) CYP3A4TRPA1MAPTPOLBPKM
SCHEMBL31265381 0.75 CYP2D6 (0.44) MAPTPOLBPKMRAD52TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12503544-B2 Elastomeric compositions and methods of use PPG INDUSTRIES OHIO, INC. (US) 2025-12-23 US disclosed
US-12503575-B2 Fine hollow particles comprising melamine-based resin KAGOSHIMA UNIVERSITY (JP) 2025-12-23 US disclosed
EP-4634157-A1 CYCLIC IMIDES AND ADHESIVE COMPOSITIONS INCLUDING THEM 3M Innovative Properties Company (US) 2025-10-22 EP disclosed
CN-113906072-B Method for producing epoxy group-terminated polyoxazolidinones 科思创德国股份有限公司 2025-05-16 CN disclosed
US-20250136838-A1 POLYCARBONATE-BASED POLYURETHANE TOPCOATS PRC-DESOTO INTERNATIONAL, INC. (US) 2025-05-01 US disclosed
CN-115943070-B Elastomeric compositions and methods of use PPG工业俄亥俄公司 2025-02-14 CN disclosed
CN-115605525-B Uretdione-containing compositions that crosslink at low temperatures 科思创德国股份有限公司 2025-01-10 CN disclosed
EP-4473028-A1 POLYCARBONATE-BASED POLYURETHANE TOPCOATS PRC-Desoto International, Inc. (US) 2024-12-11 EP disclosed
CN-118871493-A Polycarbonate-based polyurethane top coat PRC-迪索托国际公司 2024-10-29 CN disclosed
EP-3559069-B9 POLYURETHANE PREPOLYMERS INCORPORATING NONLINEAR SHORT CHAIN DIOLS AND/OR SOFT DIISOCYANATES COMPOSITIONS, AND USES THEREOF PRC DESOTO INT INC (US) 2024-10-23 EP disclosed
US-5191055-A Polythiourethanes MITSUI TOATSU CHEMICALS, INC. (JP) 1993-03-02 US disclosed
EP-0528590-A1 Mercapto compound, its preparation process, and sulfur-containing urethane resins and lenses using the same MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-02-24 EP disclosed
EP-0506315-A2 Optical urethane resins and plastic lenses comprising the same MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-09-30 EP disclosed
EP-0505150-A1 Stabilizing method of isocyanate compounds and isocyanate compositions stabilized thereby MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-09-23 EP disclosed
US-5087758-A Polythiourethane monomer MITSUI TOATSU CHEMICALS, INC. (JP) 1992-02-11 US disclosed
US-4946923-A S-alkyl thiocarbamate base resin, plastic lens comprising the resin, and process for making the lens MITSUI TOATSU CHEMICALS, INC. (JP) 1990-08-07 US disclosed
EP-0378895-A1 A mercapto compound, a high refractive index resin and lens and a process for preparing them MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-07-25 EP disclosed
CN-1036269-A Plastic lens and manufacture method thereof with high index MITSUI TOATSU CHEMICALS (JP) 1989-10-11 CN disclosed
EP-0329388-A2 Plastic lenses having high-refractive index and process for the preparation thereof MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-08-23 EP disclosed
EP-0329386-A2 S-alkyl thiocarbamate base resin, plastic lens comprising the resin, and process for making the lens MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-08-23 EP disclosed