SCHEMBL5199955

SCHEMBL5199955

O=CCc1ccc(O)c(-c2ccc(F)cc2)c1O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.36
ERCC1 P07992 2/20 0.36
ERCC4 Q92889 2/20 0.36
AKR1B1 P15121 1/20 0.34
BCL9 O00512 1/20 0.34
CTNNB1 P35222 1/20 0.34
GYS1 P13807 1/20 0.33
GCGR P47871 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32

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
SCHEMBL5200178 0.83 ELANE (0.36) AKR1B1
SCHEMBL5199656 0.75 MEP1B (0.35)
SCHEMBL1569775 0.73 CA3 (0.46)
SCHEMBL9806449 0.73 SELL (0.37)
SCHEMBL1516538 0.72 GABRA1 (0.41) ARAKR1B1GABRA1GABRB2
SCHEMBL27823662 0.70 PTGS1 (0.38)
SCHEMBL15054797 0.68 MEP1B (0.41)
SCHEMBL5198649 0.68 CYP3A4 (0.37) ERCC1ERCC4GCGR
SCHEMBL5198633 0.68 ERN1 (0.34)
SCHEMBL1829471 0.68 ERN1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1817296-A1 POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2007-08-15 EP disclosed
WO-2006057869-A1 POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2006-06-01 WO disclosed