SCHEMBL11746181

SCHEMBL11746181

Nc1ccc(-c2nc3cc(Br)c(N)cc3o2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 14/20 0.64
▸ NPC1 O15118 13/20 0.64
▸ MAPT P10636 8/20 0.64
▸ SMN1; SMN2 Q16637 7/20 0.64
▸ MEN1 O00255 6/20 0.64
▸ KMT2A Q03164 6/20 0.64
▸ KDM4E B2RXH2 6/20 0.64
▸ ALDH1A1 P00352 5/20 0.64
▸ HPGD P15428 3/20 0.64
▸ GFER P55789 2/20 0.64
▸ RXFP1 Q9HBX9 2/20 0.64
▸ GLA P06280 1/20 0.64
▸ GAA P10253 1/20 0.64
▸ ATM Q13315 2/20 0.55
▸ TP53 P04637 7/20 0.55
▸ HSD17B10 Q99714 5/20 0.55
▸ NFKB1 P19838 2/20 0.54
▸ NFKB2 Q00653 2/20 0.54
▸ RELA Q04206 2/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54

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
SCHEMBL12210849 0.85 RAB9A (0.79) RAB9ANPC1MAPTSMN1; SMN2MEN1
SCHEMBL11157432 0.84 RAB9A (0.64) RAB9ANPC1MAPTSMN1; SMN2MEN1
SCHEMBL12209688 0.83 RAB9A (0.77) RAB9ANPC1MAPTSMN1; SMN2MEN1
SCHEMBL11748987 0.81 RAB9A (0.64) RAB9ANPC1MAPTSMN1; SMN2MEN1
SCHEMBL23999977 0.79 NPC1 (0.76) RAB9ANPC1MAPTSMN1; SMN2MEN1
SCHEMBL2247467 0.79 RAB9A (0.76) RAB9ANPC1MAPTSMN1; SMN2MEN1
SCHEMBL29404722 0.78 RAB9A (1.00) RAB9ANPC1MAPTSMN1; SMN2MEN1
SCHEMBL2245075 0.78 RAB9A (1.00) RAB9ANPC1MAPTSMN1; SMN2MEN1
SCHEMBL29603993 0.78 RAB9A (0.86) RAB9ANPC1MAPTSMN1; SMN2MEN1
SCHEMBL5655662 0.78 NPC1 (0.86) RAB9ANPC1MAPTSMN1; SMN2MEN1

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
US-4024125-A Dis-azo pigments deriving from bis-diazotized diamino-2-phenyl-benzazolones HOECHST AKTIENGESELLSCHAFT (DT) 1977-05-17 — — US disclosed
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