SCHEMBL8476911

SCHEMBL8476911

O=[N+]([O-])C=Cc1c[nH]c2ccc(-c3nc4ccccc4[nH]3)cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 3/20 0.50
▸ MMP9 P14780 3/20 0.50
▸ MMP8 P22894 3/20 0.50
▸ RAB9A P51151 11/20 0.47
▸ NPC1 O15118 10/20 0.47
▸ SMN1; SMN2 Q16637 9/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ NPBWR1 P48145 3/20 0.44
▸ MAPT P10636 7/20 0.43
▸ KDM4E B2RXH2 6/20 0.43
▸ ALDH1A1 P00352 5/20 0.43
▸ HPGD P15428 4/20 0.43
▸ MMP13 P45452 2/20 0.42
▸ HTT P42858 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ SENP8 Q96LD8 1/20 0.42
▸ SENP7 Q9BQF6 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
SCHEMBL5147033 0.80 NR4A2 (0.44) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL5147034 0.80 NR4A2 (0.44) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL4072087 0.75 CYP2A6 (0.56) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL30412249 0.75 CYP2A6 (0.56) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL30345109 0.75 CYP2A6 (0.56) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL4216615 0.75 CYP2A6 (0.56) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL7368789 0.75 CYP3A4 (0.41) MAPTKDM4EALDH1A1HPGDIDO1
SCHEMBL7368793 0.75 CYP3A4 (0.41) MAPTKDM4EALDH1A1HPGDIDO1
SCHEMBL2534469 0.74 FBP1 (0.45) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL2537432 0.74 FBP1 (0.45) RAB9ANPC1MEN1KMT2AMAPT

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-5886008-A 5-arylindole derivatives PFIZER INC. (US) 1999-03-23 — — US disclosed
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