SCHEMBL7148309

SCHEMBL7148309

O=C(Cc1ccccc1)Nc1ccc(N2CCCCC2=O)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.68
ALDH1A1 P00352 3/20 0.68
KDM4E B2RXH2 2/20 0.68
NR4A1 P22736 1/20 0.68
NPC1 O15118 5/20 0.67
RAB9A P51151 5/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
CDK2 P24941 2/20 0.61
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
MCL1 Q07820 1/20 0.55
USP2 O75604 1/20 0.54
POLB P06746 1/20 0.54
HPGD P15428 1/20 0.54
BLM P54132 1/20 0.54
EPHX2 P34913 1/20 0.54
F10 P00742 2/20 0.53
HTT P42858 1/20 0.53
GAA P10253 1/20 0.53
MAPK1 P28482 1/20 0.53

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
SCHEMBL7153529 0.99 NPC1 (0.69) MAPTALDH1A1KDM4ENR4A1NPC1
SCHEMBL7154056 0.96 ALDH1A1 (0.66) MAPTALDH1A1KDM4ENR4A1NPC1
SCHEMBL7088328 0.88 MAPT (0.68) MAPTALDH1A1KDM4ENR4A1NPC1
SCHEMBL7149795 0.85 USP2 (0.57) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7091303 0.84 MAPT (0.66) MAPTALDH1A1KDM4ENR4A1NPC1
SCHEMBL5163049 0.83 NAMPT (0.48) MAPTALDH1A1KDM4ENR4A1NPC1
SCHEMBL6140778 0.82 MAPT (0.64) MAPTALDH1A1KDM4ENR4A1NPC1
SCHEMBL7150779 0.82 HTT (0.63) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7150787 0.82 RAB9A (0.54) MAPTALDH1A1KDM4ENR4A1NPC1
SCHEMBL7157379 0.82 NPY2R (0.60) MAPTALDH1A1KDM4ENR4A1NPC1

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
EP-1351938-A1 PHENYL DERIVATIVES MERCK PATENT GmbH (DE) 2003-10-15 EP claimed
WO-2002057236-A1 PHENYL DERIVATIVES MERCK PATENT GMBH (DE) 2002-07-25 WO claimed
EP-1351938-A1 PHENYL DERIVATIVES MERCK PATENT GmbH (DE) 2003-10-15 EP disclosed
WO-2002057236-A1 PHENYL DERIVATIVES MERCK PATENT GMBH (DE) 2002-07-25 WO disclosed