SCHEMBL7698573

SCHEMBL7698573

Fc1ccccc1N1CCN(c2cnc3cc4ccccc4cc3n2)CC1.c1cnc(N2CCN(c3cnc4cc5ccccc5cc4n3)CC2)nc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.67
▸ SMN1; SMN2 Q16637 3/20 0.67
▸ NFKB1 P19838 2/20 0.67
▸ NFKB2 Q00653 2/20 0.67
▸ RELA Q04206 2/20 0.67
▸ LMNA P02545 2/20 0.67
▸ NPSR1 Q6W5P4 1/20 0.67
▸ NPC1 O15118 5/20 0.50
▸ RAB9A P51151 4/20 0.50
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ ALDH1A1 P00352 6/20 0.44
▸ GAA P10253 3/20 0.44
▸ HPGD P15428 2/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ GLA P06280 1/20 0.44
▸ HTT P42858 2/20 0.44
▸ HCRTR1 O43613 4/20 0.43
▸ HCRTR2 O43614 4/20 0.43
▸ POLB P06746 1/20 0.42

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
SCHEMBL7697304 0.93 MAPT (0.77) MAPTSMN1; SMN2NFKB1NFKB2RELA
SCHEMBL7697028 0.89 NPC1 (0.61) MAPTSMN1; SMN2NFKB1NFKB2RELA
Hydrochloric Acid SCHEMBL27803387 0.79 GAA (0.62) MAPTSMN1; SMN2NFKB1NFKB2RELA
SCHEMBL7699332 0.78 MAPT (0.51) MAPTSMN1; SMN2NFKB1NFKB2RELA
SCHEMBL7690144 0.75 NPC1 (0.77) MAPTSMN1; SMN2NFKB1NFKB2RELA
SCHEMBL7695990 0.74 NPC1 (0.64) MAPTSMN1; SMN2NFKB1NFKB2RELA
SCHEMBL7697600 0.74 MAPT (0.74) MAPTSMN1; SMN2NFKB1NFKB2RELA
SCHEMBL7693429 0.74 HTR3A (0.74) MAPTSMN1; SMN2NFKB1NFKB2RELA
SCHEMBL7694046 0.73 NPC1 (0.51) MAPTSMN1; SMN2NFKB1NFKB2RELA
SCHEMBL7689945 0.71 MAPT (0.53) MAPTSMN1; SMN2NFKB1NFKB2RELA

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 claimed
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