SCHEMBL7690144

SCHEMBL7690144

Fc1ccc(N2CCN(c3cnc4cc5ccccc5cc4n3)CC2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.77
▸ RAB9A P51151 6/20 0.77
▸ MEN1 O00255 2/20 0.77
▸ KMT2A Q03164 2/20 0.77
▸ MAPT P10636 10/20 0.58
▸ ALDH1A1 P00352 5/20 0.58
▸ SMN1; SMN2 Q16637 4/20 0.58
▸ NFKB1 P19838 2/20 0.58
▸ NFKB2 Q00653 2/20 0.58
▸ RELA Q04206 2/20 0.58
▸ HPGD P15428 2/20 0.58
▸ GAA P10253 2/20 0.58
▸ HTT P42858 1/20 0.58
▸ KDM4E B2RXH2 4/20 0.57
▸ NPSR1 Q6W5P4 3/20 0.57
▸ LMNA P02545 3/20 0.51
▸ HRH4 Q9H3N8 2/20 0.48
▸ HTR3A P46098 1/20 0.48
▸ SLC6A2 P23975 2/20 0.47
▸ SLC6A4 P31645 2/20 0.47

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
SCHEMBL7697600 0.88 MAPT (0.74) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL7697304 0.81 MAPT (0.77) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL7693429 0.80 HTR3A (0.74) NPC1RAB9AKMT2AMAPTALDH1A1
SCHEMBL7689945 0.80 MAPT (0.53) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL7694046 0.79 NPC1 (0.51) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL7699332 0.78 MAPT (0.51) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL7697028 0.78 NPC1 (0.61) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL7696139 0.78 MAPT (0.55) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL7695990 0.75 NPC1 (0.64) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL7698573 0.75 MAPT (0.67) NPC1RAB9AMEN1KMT2AMAPT

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-2002094796-A2 BENZO[G]QUINOXALINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST INFECTIOUS DISEASES AXXIMA PHARMACEUTICALS AG (DE) 2002-11-28 — — WO disclosed
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