SCHEMBL9492845

SCHEMBL9492845

CC(C)(C)c1cc(C(=O)NNC(=O)c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A2 O00482 1/20 0.64
NR5A1 Q13285 1/20 0.64
ALOX5 P09917 4/20 0.45
PTGS2 P35354 4/20 0.45
ALDH1A1 P00352 3/20 0.43
GAA P10253 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
GLRA3 O75311 1/20 0.43
GLRB P48167 1/20 0.43
GABRA1 P14867 1/20 0.42
GABRB2 P47870 1/20 0.42
CA2 P00918 2/20 0.41
CA1 P00915 1/20 0.41
HSP90AA1 P07900 1/20 0.41
POLB P06746 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TYR P14679 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 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
SCHEMBL9179460 0.89 NR5A2 (0.54) NR5A2NR5A1ALOX5PTGS2ALDH1A1
SCHEMBL10577013 0.86 NR5A2 (0.65) NR5A2NR5A1ALOX5PTGS2ALDH1A1
SCHEMBL27348030 0.83 NR5A2 (0.74) NR5A2NR5A1ALOX5PTGS2ALDH1A1
SCHEMBL28742131 0.83 NR5A2 (0.56) NR5A2NR5A1ALOX5PTGS2ALDH1A1
SCHEMBL30861606 0.83 NR5A2 (0.56) NR5A2NR5A1ALOX5PTGS2ALDH1A1
SCHEMBL29670054 0.83 NR5A2 (0.56) NR5A2NR5A1ALOX5PTGS2ALDH1A1
SCHEMBL27195660 0.83 NR5A2 (0.56) NR5A2NR5A1ALOX5PTGS2ALDH1A1
SCHEMBL6858504 0.81 NR5A2 (0.55) NR5A2NR5A1ALOX5PTGS2ALDH1A1
SCHEMBL132940 0.81 NR5A2 (0.55) NR5A2NR5A1ALOX5PTGS2ALDH1A1
SCHEMBL4075760 0.81 NR5A2 (0.55) NR5A2NR5A1ALOX5PTGS2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300453-B1 COPPER-TYPE CONDUCTIVE COATING COMPOSITION MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1993-03-03 EP disclosed
US-4921623-A COPPER POWDER, SALICYCLIC ACID DERIVATIVE, STABILITY MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1990-05-01 US disclosed
EP-0300453-A2 Copper-type conductive coating composition MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1989-01-25 EP disclosed
US-4306930-A INCORPORATING A HYDRAZIDE OR DIHYDRAZIDE AND THEN VULCANIZING IN CONTACT WITH A METAL CIBA-GEIGY CORPORATION (US) 1981-12-22 US disclosed
US-4077948-A N-SALICYLIDENE-N*-SALICYLHYDRAZIDES CIBA-GEIGY CORPORATION (US) 1978-03-07 US disclosed
US-3994987-A Metal deactivators as adhesion promotors for vulcanizable elastomers to metals CIBA-GEIGY CORPORATION (US) 1976-11-30 US disclosed