SCHEMBL806872

SCHEMBL806872

CS(=O)(=O)c1cc(F)c(O)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 2/20 0.37
CA3 P07451 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
ENPP2 Q13822 1/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
PIK3CG P48736 1/20 0.32
ADRB2 P07550 1/20 0.32
CA2 P00918 3/20 0.32
CA1 P00915 2/20 0.32
PTGS2 P35354 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
CA12 O43570 1/20 0.31
CA7 P43166 1/20 0.31

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
SCHEMBL796657 0.81 CCR2 (0.41) CCR2EGLN1CA2CA1PTGS2
SCHEMBL17056247 0.78 CA3 (0.33) CA3CA6CA5ACA9CA14
SCHEMBL13003581 0.76 L3MBTL1 (0.41) CCR2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL17158071 0.74 PKM (0.38) CCR2CA9CA2CA1PTGS2
SCHEMBL806713 0.74 CA12 (0.39) CCR2CA6CA5ACA9CA14
SCHEMBL24651345 0.73 L3MBTL1 (0.42) CCR2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL1128576 0.72 ENPP2 (0.45) CCR2ENPP2PIK3CDPIK3CAPIK3CB
SCHEMBL22396850 0.72 ENPP2 (0.45) CCR2ENPP2L3MBTL1
SCHEMBL5513421 0.72 CA9 (0.53) CA3CA6CA5ACA9CA14
SCHEMBL806761 0.71 SMN1; SMN2 (0.47) PTGS2

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-2012037393-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA INC. (US) 2012-03-22 WO disclosed