SCHEMBL4746488

SCHEMBL4746488

CC(c1ccc(F)cc1F)N1Cc2c(N)cc(Br)cc2C1=O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.39
KCNH2 Q12809 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
OPRM1 P35372 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
SCHEMBL4746487 1.00 HSD11B1 (0.39) HSD11B1KCNH2SIGMAR1OPRM1
SCHEMBL4748815 0.82 HSD11B1 (0.39) HSD11B1KCNH2SIGMAR1OPRM1
SCHEMBL4746505 0.82 HSD11B1 (0.39) HSD11B1KCNH2SIGMAR1OPRM1
SCHEMBL4746540 0.78 IDO1 (0.34) HSD11B1SIGMAR1OPRM1
SCHEMBL4746538 0.78 IDO1 (0.34) HSD11B1SIGMAR1OPRM1
SCHEMBL4748978 0.72 P2RX7 (0.39)
SCHEMBL4788355 0.64 HSD11B1 (0.44) HSD11B1SIGMAR1
SCHEMBL25238827 0.64 KCNH2 (0.30) KCNH2
SCHEMBL25779511 0.63 KCNH2 (0.31) KCNH2
SCHEMBL31145949 0.63 HSD11B1 (0.43) HSD11B1SIGMAR1

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