SCHEMBL11117955

SCHEMBL11117955

CCCCCCc1c(CC)ccc(C(=O)O)c1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GCGR P47871 2/20 0.51
RARB P10826 3/20 0.48
PPARA Q07869 3/20 0.46
RARA P10276 1/20 0.45
RARG P13631 1/20 0.45
PLK1 P53350 3/20 0.43
PPARG P37231 2/20 0.43
DHFR P00374 1/20 0.43
KAT8 Q9H7Z6 4/20 0.43
BID P55957 3/20 0.43
MCL1 Q07820 3/20 0.43
BCL2L1 Q07817 2/20 0.43
BAK1 Q16611 2/20 0.43
EP300 Q09472 1/20 0.43
KAT2A Q92830 1/20 0.43
KAT2B Q92831 1/20 0.43
KAT5 Q92993 1/20 0.43
SAE1 Q9UBE0 1/20 0.43
PLK3 Q9H4B4 2/20 0.41

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
SCHEMBL11323683 0.87 RARB (0.49) GCGRRARBPPARARARARARG
SCHEMBL983338 0.83 GCGR (0.53) GCGRPPARAPPARGDHFRKAT8
SCHEMBL982595 0.83 GCGR (0.53) GCGRPPARAPPARGDHFRKAT8
SCHEMBL984780 0.83 GCGR (0.53) GCGRPPARAPPARGDHFRKAT8
SCHEMBL984798 0.83 GCGR (0.53) GCGRPPARAPPARGDHFRKAT8
SCHEMBL984920 0.83 GCGR (0.53) GCGRPPARAPPARGDHFRKAT8
SCHEMBL982876 0.83 GCGR (0.53) GCGRPPARAPPARGDHFRKAT8
SCHEMBL981445 0.81 GCGR (0.55) GCGRPPARAPPARGDHFRKAT8
SCHEMBL5666740 0.81 PPARA (0.53) GCGRRARBPPARARARARARG
SCHEMBL28360757 0.80 GABRP (0.43) RARBPPARARARARARGPPARG

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
EP-0107492-A2 Helichromic-smectic liquid crystal compositions and display cells MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-05-02 EP claimed