SCHEMBL21537522

SCHEMBL21537522

Cc1cc(O)c(C(C)(C)C)cc1CC(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.49
CYP2C9 P11712 5/20 0.49
CYP2C19 P33261 4/20 0.49
CYP2D6 P10635 4/20 0.49
TP53 P04637 3/20 0.49
ALDH1A1 P00352 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
HIF1A Q16665 3/20 0.49
CYP3A4 P08684 2/20 0.49
MAPK1 P28482 2/20 0.49
TSHR P16473 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CYP1A2 P05177 4/20 0.48
KDM4E B2RXH2 1/20 0.48
MAPT P10636 1/20 0.48
ATP2A2 P16615 1/20 0.48
ATP2A3 Q93084 1/20 0.48
GABRA1 P14867 2/20 0.41
GABRB2 P47870 2/20 0.41
HSD17B10 Q99714 2/20 0.39

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
SCHEMBL12443140 0.85 ALOX15 (0.43) ALOX15CYP2C9CYP2C19CYP2D6TP53
SCHEMBL12443090 0.85 ALOX15 (0.50) ALOX15CYP2C9CYP2C19CYP2D6TP53
SCHEMBL28373736 0.83 CYP2C9 (0.55) ALOX15CYP2C9CYP2C19CYP2D6TP53
SCHEMBL12443089 0.81 ALOX15 (0.58) ALOX15CYP2C9CYP2C19CYP2D6TP53
SCHEMBL18455724 0.81 ALOX15 (0.52) ALOX15CYP2C9CYP2C19CYP2D6TP53
SCHEMBL9230440 0.81 ALOX15 (0.56) ALOX15CYP2C9CYP2C19CYP2D6TP53
SCHEMBL30807859 0.81 ALDH1A1 (0.56) ALOX15CYP2C9CYP2C19CYP2D6TP53
SCHEMBL68939 0.81 ALDH1A1 (0.56) ALOX15CYP2C9CYP2C19CYP2D6TP53
SCHEMBL12393879 0.80 CYP2C9 (0.59) ALOX15CYP2C9CYP2C19CYP2D6TP53
SCHEMBL3152567 0.80 ALOX15 (0.51) ALOX15CYP2C9CYP2C19CYP2D6TP53

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112449645-B Polycarbonate resin and method for producing same 三菱瓦斯化学株式会社 2022-09-23 CN disclosed
CN-112449645-A Polycarbonate resin and method for producing same 三菱瓦斯化学株式会社 2021-03-05 CN disclosed
WO-2020022130-A1 POLYCARBONATE RESIN AND METHOD FOR PRODUCING SAME 三菱瓦斯化学株式会社 2020-01-30 WO disclosed
EP-3129829-B1 LIQUID CRYSTAL MATERIAL MERCK PATENT GMBH (DE) 2019-10-30 EP disclosed
CN-101616956-B Polymer-(organo)clay complex, composition comprising the complex, sheet-like material comprising the complex or composition, and method for production of polymer-(organo)clay complex ASAHI CHEMICAL CORP (JP) 2012-08-22 CN disclosed
CN-101616956-A Polymkeric substance-(organic) clay complex, use the composition of this mixture and use the manufacture method of their flap and polymkeric substance-(organic) clay complex ASAHI CHEMICAL CORP (JP) 2009-12-30 CN disclosed
CN-100345890-C Resin and article molded therefrom TORAY INDUSTRIES (JP) 2007-10-31 CN disclosed
CN-100334138-C Resin, resin compositions, process for production thereof, and moldings made by using the same TORAY INDUSTRIES (JP) 2007-08-29 CN disclosed
CN-1795226-A Resin and article molded therefrom TORAY INDUSTRIES (JP) 2006-06-28 CN disclosed
CN-1757130-A Polymer electrolyte material, polymer electrolyte part, film electrode composite element and polymer electrolyte fuel cells TORAY INDUSTRIES (JP) 2006-04-05 CN disclosed
CN-1649940-A Resin, resin compositions, process for production thereof, and moldings made by using the same TORAY INDUSTRIES (JP) 2005-08-03 CN disclosed