SCHEMBL4748815

SCHEMBL4748815

C[C@H](c1ccc(F)cc1F)N1Cc2cc(Br)cc(N)c2C1=O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.39
PIK3CG P48736 3/20 0.33
KCNH2 Q12809 1/20 0.32
PIK3CD O00329 1/20 0.32
PIK3R1 P27986 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
SDCBP O00560 1/20 0.31
SDC2 P34741 1/20 0.31
OXTR P30559 1/20 0.31
OPRM1 P35372 1/20 0.31
MC4R P32245 1/20 0.30
DPP4 P27487 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30
DPP7 Q9UHL4 1/20 0.30

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
SCHEMBL4746505 1.00 HSD11B1 (0.39) HSD11B1PIK3CGKCNH2PIK3CDPIK3R1
SCHEMBL4746488 0.82 HSD11B1 (0.39) HSD11B1KCNH2SIGMAR1OPRM1
SCHEMBL4746487 0.82 HSD11B1 (0.39) HSD11B1KCNH2SIGMAR1OPRM1
SCHEMBL4746540 0.78 IDO1 (0.34) HSD11B1SIGMAR1OPRM1
SCHEMBL4746538 0.78 IDO1 (0.34) HSD11B1SIGMAR1OPRM1
SCHEMBL4746032 0.72 P2RX7 (0.39)
SCHEMBL22440916 0.72 PIK3CG (0.54) PIK3CGPIK3CDPIK3R1
SCHEMBL22440915 0.72 PIK3CG (0.54) PIK3CGPIK3CDPIK3R1
SCHEMBL2023945 0.71 PIK3CG (0.50) HSD11B1PIK3CGKCNH2PIK3CDPIK3R1
SCHEMBL2019136 0.71 PIK3CG (0.50) HSD11B1PIK3CGKCNH2PIK3CDPIK3R1

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-2008124518-A1 OXO-DIHYDROISOINDOLE SULFONAMIDE COMPOUNDS AS MODULATORS OF THE CCK2 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2008-10-16 WO disclosed