SCHEMBL28049057

SCHEMBL28049057

CCc1ccc(-c2sccc2OC)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.42
TUBB1 Q9H4B7 3/20 0.39
GAA P10253 2/20 0.38
PTGS2 P35354 2/20 0.37
TUBB4A P04350 2/20 0.36
TUBB P07437 2/20 0.36
TUBA3C P0DPH7 2/20 0.36
TUBA1B P68363 2/20 0.36
TUBA4A P68366 2/20 0.36
TUBB4B P68371 2/20 0.36
TUBB3 Q13509 2/20 0.36
TUBB2A Q13885 2/20 0.36
TUBB8 Q3ZCM7 2/20 0.36
TUBA3E Q6PEY2 2/20 0.36
TUBA1A Q71U36 2/20 0.36
TUBA1C Q9BQE3 2/20 0.36
TUBB6 Q9BUF5 2/20 0.36
TUBB2B Q9BVA1 2/20 0.36
KMT2A Q03164 2/20 0.36
PTGS1 P23219 2/20 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
SCHEMBL11438563 0.78 ESR2 (0.45) KEAP1TUBB1GAAPTGS2TUBB4A
SCHEMBL8778284 0.77 KEAP1 (0.42) KEAP1TUBB1PTGS2TUBB4ATUBB
SCHEMBL5133848 0.76 KEAP1 (0.52) KEAP1TUBB1GAAPTGS2TUBB4A
SCHEMBL10829183 0.76 CYP2A6 (0.48) GAAKMT2APTGS1RAB9AMEN1
SCHEMBL1622032 0.74 PGR (0.41) GAAKMT2APTGS1RAB9AMEN1
SCHEMBL19351463 0.74 KEAP1 (0.44) KEAP1TUBB1GAAPTGS2TUBB4A
SCHEMBL29093404 0.71 PTGS1 (0.39) GAAKMT2APTGS1RAB9AMEN1
SCHEMBL16049288 0.71 PTGS1 (0.46) GAAPTGS2KMT2APTGS1RAB9A
SCHEMBL11629336 0.70 RAB9A (0.49) GAAKMT2APTGS1RAB9AMEN1
SCHEMBL26036242 0.69 HSD17B10 (0.44) TUBB1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105209446-A GPR120 agonists for the treatment of type ii diabetes JANSSEN PHARMACEUTICA NV 2015-12-30 CN disclosed