SCHEMBL28292707

SCHEMBL28292707

Nc1ccc(-c2ccc(-c3nc4ccc(N)cc4o3)cc2)cc1

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 16/20 0.96
NPC1 O15118 15/20 0.96
MAPT P10636 11/20 0.96
KDM4E B2RXH2 9/20 0.96
ALDH1A1 P00352 9/20 0.96
SMN1; SMN2 Q16637 8/20 0.96
MEN1 O00255 7/20 0.96
KMT2A Q03164 7/20 0.96
HPGD P15428 6/20 0.96
GLA P06280 2/20 0.96
GAA P10253 2/20 0.96
GFER P55789 3/20 0.72
RXFP1 Q9HBX9 2/20 0.72
ATM Q13315 2/20 0.67
TP53 P04637 5/20 0.59
HSD17B10 Q99714 3/20 0.59
NFKB1 P19838 2/20 0.59
NFKB2 Q00653 2/20 0.59
RELA Q04206 2/20 0.59
L3MBTL1 Q9Y468 1/20 0.59

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
SCHEMBL2245075 0.98 RAB9A (1.00) RAB9ANPC1MAPTKDM4EALDH1A1
SCHEMBL2491134 0.96 RAB9A (0.96) RAB9ANPC1MAPTKDM4EALDH1A1
SCHEMBL5655662 0.91 NPC1 (0.86) RAB9ANPC1MAPTKDM4EALDH1A1
SCHEMBL29556075 0.90 RAB9A (0.84) RAB9ANPC1MAPTKDM4EALDH1A1
SCHEMBL2697521 0.90 RAB9A (0.84) RAB9ANPC1MAPTKDM4EALDH1A1
SCHEMBL28291247 0.89 NPC1 (0.77) RAB9ANPC1MAPTKDM4EALDH1A1
SCHEMBL17199120 0.88 NPC1 (0.81) RAB9ANPC1MAPTKDM4EALDH1A1
SCHEMBL2240357 0.88 NPC1 (0.81) RAB9ANPC1MAPTKDM4EALDH1A1
SCHEMBL4147179 0.88 NPC1 (0.81) RAB9ANPC1MAPTKDM4EALDH1A1
SCHEMBL517126 0.88 NPC1 (0.81) RAB9ANPC1MAPTKDM4EALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109734908-B Polyamide acid and preparation method thereof, polyimide and preparation method of polyimide film 武汉柔显科技股份有限公司 2021-01-12 CN disclosed
CN-109734908-A The preparation method of polyamic acid and preparation method, polyimides and Kapton 武汉柔显科技股份有限公司 2019-05-10 CN disclosed