SCHEMBL2235010

SCHEMBL2235010

CCCCC(=Cc1ccc(O)c(F)c1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 0.47
PTGES O14684 6/20 0.47
PPARG P37231 4/20 0.47
IAPP P10997 3/20 0.46
CAPN1 P07384 1/20 0.43
MGLL Q99685 3/20 0.41
APP P05067 1/20 0.41
APEX1 P27695 1/20 0.39
PSEN1 P49768 2/20 0.39
SNCA P37840 1/20 0.38
FAAH O00519 2/20 0.37
CNR1 P21554 2/20 0.37

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
SCHEMBL6060200 0.89 ALOX5 (0.49) ALOX5PTGESPPARGIAPPCAPN1
SCHEMBL31256756 0.87 IAPP (0.60) ALOX5PTGESPPARGIAPPCAPN1
SCHEMBL2233170 0.84 ALOX5 (0.50) ALOX5PTGESPPARGIAPPCAPN1
SCHEMBL2232408 0.83 ALOX5 (0.47) ALOX5PTGESPPARGIAPPCAPN1
SCHEMBL13103445 0.83 ALOX5 (0.49) ALOX5PTGESPPARGIAPPCAPN1
SCHEMBL3437102 0.83 ALOX5 (0.49) ALOX5PTGESPPARGIAPPCAPN1
SCHEMBL3437103 0.83 ALOX5 (0.49) ALOX5PTGESPPARGIAPPCAPN1
SCHEMBL16429273 0.82 APP (0.62) ALOX5PTGESPPARGIAPPCAPN1
SCHEMBL16429275 0.82 APP (0.62) ALOX5PTGESPPARGIAPPCAPN1
SCHEMBL30839919 0.82 APP (0.62) ALOX5PTGESPPARGIAPPCAPN1

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
WO-2011093524-A1 DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2011-08-04 WO disclosed