SCHEMBL19257555

SCHEMBL19257555

Bc1cc(-c2ccc(OC)c(Cl)c2)ccc1-c1ccc(OC)cc1CCC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
HSD17B10 Q99714 1/20 0.44
S1PR1 P21453 1/20 0.41
FFAR1 O14842 6/20 0.40
EGFR P00533 2/20 0.40
PDGFRB P09619 2/20 0.40
FGFR1 P11362 2/20 0.40
KDR P35968 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
GAA P10253 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
LMNA P02545 1/20 0.38
ATM Q13315 1/20 0.38
ERCC5 P28715 1/20 0.38
FEN1 P39748 1/20 0.38
KMO O15229 1/20 0.38

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
SCHEMBL19257560 0.88 POLB (0.46) POLBHSD17B10FFAR1EGFRPDGFRB
SCHEMBL19257270 0.85 POLB (0.43) POLBHSD17B10S1PR1FFAR1EGFR
SCHEMBL15602007 0.84 POLB (0.46) POLBHSD17B10S1PR1FFAR1TDP1
SCHEMBL19209491 0.81 S1PR1 (0.46) POLBHSD17B10S1PR1FFAR1
SCHEMBL19257272 0.79 POLB (0.50) POLBHSD17B10S1PR1FFAR1EGFR
SCHEMBL16863734 0.75 POLB (0.48) POLBFFAR1PDGFRBFGFR1KDR
SCHEMBL491188 0.75 HSD17B10 (0.71) POLBHSD17B10
SCHEMBL30436820 0.75 HSD17B10 (0.71) POLBHSD17B10
SCHEMBL38659657 0.74 POLB (0.50) POLBHSD17B10S1PR1FFAR1GAA
SCHEMBL1891972 0.74 POLB (0.50) POLBHSD17B10S1PR1FFAR1GAA

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-2017134146-A1 GPBP INHIBITORS AND USES AND SCALEABLE SYNTHESIS THEREOF FIBROSTATIN, S.L. (ES) 2017-08-10 WO disclosed