SCHEMBL8410091

SCHEMBL8410091

ONc1ccc(NO)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.67
ALDH1A1 P00352 3/20 0.58
HSD17B10 Q99714 2/20 0.58
HTR6 P50406 1/20 0.34
L3MBTL1 Q9Y468 4/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
ALOX12 P18054 1/20 0.33
PTGS1 P23219 1/20 0.33
SLC6A2 P23975 1/20 0.33
MAPK1 P28482 1/20 0.33
PTGS2 P35354 1/20 0.33
HTR2B P41595 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
APP P05067 1/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
THRB P10828 1/20 0.32
RAB9A P51151 1/20 0.30

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
SCHEMBL3388548 0.89 IDO1 (0.56) IDO1ALDH1A1HSD17B10L3MBTL1RAB9A
SCHEMBL602301 0.86
SCHEMBL2395890 0.83
SCHEMBL3713416 0.83
SCHEMBL328427 0.83
SCHEMBL98114 0.83
SCHEMBL11409017 0.83
SCHEMBL6771434 0.83
SCHEMBL98310 0.81
Hydrochloric Acid SCHEMBL5229360 0.80 IDO1 (0.48) IDO1ALDH1A1HSD17B10TSHRPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-11049732-A None JP disclosed
JP-H1149732-A PRODUCTION OF 4,6-DIAMINORESORCIN TOYO KASEI KOGYO CO LTD 1999-02-23 JP disclosed
US-4838894-A SUBSTITUTED M-AMINOPHENOLS; OXIDATION DYES CLAIROL INCORPORATED (US) 1989-06-13 US disclosed
EP-0215560-A1 Hair dye coupler and process for making Bristol-Myers Company (US) 1987-03-25 EP disclosed