SCHEMBL7430696

SCHEMBL7430696

Nc1cc(F)c(OCc2ccccc2)cc1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.49
MAPK14 Q16539 1/20 0.49
KDM1A O60341 7/20 0.48
MAOB P27338 2/20 0.46
MAPT P10636 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
GAA P10253 1/20 0.46
MAOA P21397 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
APP P05067 1/20 0.45
NPC1 O15118 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.44
PTGER1 P34995 1/20 0.43
CYP19A1 P11511 1/20 0.43
HTR1A P08908 1/20 0.43
DRD2 P14416 1/20 0.43
S1PR5 Q9H228 1/20 0.43

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
SCHEMBL13504467 0.91 LTA4H (0.47) LTA4HMAPK14KDM1AMAOBMAPT
SCHEMBL810075 0.91 LTA4H (0.47) LTA4HMAPK14KDM1AMAOBMAPT
SCHEMBL29178713 0.91 LTA4H (0.47) LTA4HMAPK14KDM1AMAOBMAPT
SCHEMBL14259448 0.88 LTA4H (0.47) LTA4HMAPK14KDM1AMAOBMAPT
SCHEMBL23898522 0.87 APP (0.47) LTA4HMAPK14KDM1AMAOBMAPT
SCHEMBL30739394 0.87 MAPT (0.49) LTA4HMAPK14KDM1AMAOBMAPT
SCHEMBL8313819 0.87 LTA4H (0.56) LTA4HMAPK14MAOBMAPTL3MBTL1
SCHEMBL3920530 0.86 LTA4H (0.49) LTA4HMAPK14KDM1AMAOBMAPT
SCHEMBL582711 0.83 FOLH1 (0.51) L3MBTL1NPC1MRGPRX4PTGER1S1PR5
SCHEMBL7426704 0.81 PTGES (0.51) MAPTCYP19A1

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
EP-1117651-A1 NEW BIS-BENZIMIDAZOLES Bayer Aktiengesellschaft (DE) 2001-07-25 EP disclosed
WO-2000020401-A1 NEW BIS-BENZIMIDAZOLES BAYER AKTIENGESELLSCHAFT (DE) 2000-04-13 WO disclosed