SCHEMBL11075357

SCHEMBL11075357

CCC(c1ccccc1OC)C(CC=CCCCCCCCCC(=O)O)c1ccccc1OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.44
CYSLTR1 Q9Y271 1/20 0.44
ALDH1A1 P00352 7/20 0.44
F7 P08709 7/20 0.44
F3 P13726 7/20 0.44
PPARG P37231 5/20 0.44
CYP19A1 P11511 4/20 0.44
PPARD Q03181 4/20 0.44
PPARA Q07869 4/20 0.44
MAPT P10636 4/20 0.44
HSD17B10 Q99714 4/20 0.44
LMNA P02545 3/20 0.44
ALOX15 P16050 3/20 0.44
PTGS1 P23219 3/20 0.44
BLM P54132 3/20 0.44
FABP4 P15090 3/20 0.44
OXER1 Q8TDS5 2/20 0.44
KDM4E B2RXH2 2/20 0.44
FFAR1 O14842 2/20 0.44
CYP3A4 P08684 2/20 0.44

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
SCHEMBL9862579 0.78 CNR1 (0.48) ALDH1A1F7F3PPARGCYP19A1
SCHEMBL26092579 0.76 FFAR1 (0.54) ALDH1A1F7F3PPARGCYP19A1
SCHEMBL27295163 0.74 PPARG (0.46) CYSLTR2CYSLTR1ALDH1A1F7F3
SCHEMBL8080168 0.74 LTB4R (0.54) CYSLTR2CYSLTR1ALDH1A1F7F3
SCHEMBL8080171 0.74 LTB4R (0.54) CYSLTR2CYSLTR1ALDH1A1F7F3
Oleic Acid SCHEMBL9757479 0.71 PPARG (0.64) ALDH1A1F7F3PPARGCYP19A1
SCHEMBL30513702 0.71 PPARG (0.62) ALDH1A1F7F3PPARGCYP19A1
SCHEMBL20739827 0.70 POLM (0.62) PPARGKDM4ECYP3A4RECQLKMT2A
SCHEMBL26090058 0.70 POLM (0.62) PPARGKDM4ECYP3A4RECQLKMT2A
SCHEMBL27862386 0.70 KMT2A (0.51) ALDH1A1LMNAPTGS1HPGDKMT2A

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-0124369-A1 Phenol derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-11-07 EP disclosed