SCHEMBL7364197

SCHEMBL7364197

O=C(Nc1ccc(F)cc1)c1c[nH]c2c1C(=O)CCCC2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 1/20 0.43
RAB9A P51151 3/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
SCN8A Q9UQD0 1/20 0.43
SCN10A Q9Y5Y9 1/20 0.43
NPC1 O15118 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.40
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
MAPK14 Q16539 1/20 0.40
MAPT P10636 1/20 0.40
P2RX1 P51575 1/20 0.39
PTPN1 P18031 1/20 0.39
BUB1 O43683 1/20 0.39

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
SCHEMBL7360138 0.97 LMNA (0.43) TP53SMN1; SMN2LMNARAB9AMAPK1
SCHEMBL7363737 0.88 LMNA (0.49) SMN1; SMN2LMNARAB9ANPC1MEN1
SCHEMBL7360053 0.87 CFTR (0.49) TP53SMN1; SMN2LMNAHTTMEN1
SCHEMBL7364883 0.86 LMNA (0.46) TP53SMN1; SMN2LMNARAB9AHTT
SCHEMBL7361057 0.85 POLB (0.46) RAB9AHTTNPC1RXFP1MEN1
SCHEMBL7397423 0.85 NPC1 (0.44) TP53SMN1; SMN2LMNARAB9AHTT
SCHEMBL7364057 0.85 MAPT (0.43) TP53SMN1; SMN2LMNARAB9ANPC1
SCHEMBL7397449 0.85 MAPT (0.47) SMN1; SMN2HTTMEN1KMT2AKDM4E
SCHEMBL7367371 0.85 NTRK3 (0.42) SMN1; SMN2LMNARAB9ANPC1MEN1
SCHEMBL7366047 0.85 ROCK2 (0.42) TP53SMN1; SMN2LMNARAB9AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998002420-A9 CERTAIN FUSED PYRROLECARBOXANILIDES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS 1998-04-23 WO claimed
WO-1998002420-A1 CERTAIN FUSED PYRROLECARBOXANILIDES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 1998-01-22 WO claimed
WO-1998002420-A9 CERTAIN FUSED PYRROLECARBOXANILIDES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS 1998-04-23 WO disclosed
WO-1998002420-A1 CERTAIN FUSED PYRROLECARBOXANILIDES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 1998-01-22 WO disclosed