SCHEMBL28170347

SCHEMBL28170347

CCC(Cc1ccc(O)c(C(C)(C)C)c1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
XBP1 P17861 1/20 0.49
ATM Q13315 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PPARA Q07869 8/20 0.46
PPARG P37231 6/20 0.46
PPARD Q03181 4/20 0.46
HSP90AA1 P07900 1/20 0.44
HSP90AB1 P08238 1/20 0.44
KDM6B O15054 1/20 0.43
RARB P10826 1/20 0.43
RARG P13631 1/20 0.43
EPHX2 P34913 2/20 0.42
ALOX15 P16050 2/20 0.42
HSD17B10 Q99714 2/20 0.42
NR1I2 O75469 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
CYP2C9 P11712 1/20 0.42

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
SCHEMBL30891619 0.91 KDM6B (0.45) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL18040263 0.88 KDM6B (0.43) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL6750769 0.87 GAA (0.45) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL2131061 0.86 KDM6B (0.41) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL604340 0.85 GAA (0.50) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL30077243 0.83 GAA (0.40) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL2133184 0.83 GAA (0.40) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL1286430 0.83 HMGCR (0.51) GAAATMNPSR1ALOX15ALDH1A1
SCHEMBL9845237 0.82 KDM6B (0.45) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL7271971 0.81 KDM6B (0.44) GAAXBP1ATMNPSR1L3MBTL1

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-107109103-A Resin composition for forming cured film, conductive member, and method for inhibiting corrosion of metal electrode and/or metal wiring 日产化学工业株式会社 2017-08-29 CN disclosed