SCHEMBL9721905

SCHEMBL9721905

Oc1ccc(O)c2ccccc12.Oc1cccc2c(O)cccc12

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 6/20 0.87
HPGD P15428 4/20 0.68
HSD17B10 Q99714 4/20 0.68
ALOX15 P16050 3/20 0.68
RECQL P46063 3/20 0.68
TDP1 Q9NUW8 3/20 0.68
MAPT P10636 2/20 0.68
CYP1A2 P05177 2/20 0.68
APP P05067 1/20 0.68
THRB P10828 1/20 0.68
TSHR P16473 1/20 0.68
CASP1 P29466 1/20 0.68
SNCA P37840 1/20 0.68
EP300 Q09472 2/20 0.62
KAT2B Q92831 2/20 0.62
KAT8 Q9H7Z6 2/20 0.62
HDAC3 O15379 1/20 0.62
NCOR2 Q9Y618 1/20 0.62
ALDH1A1 P00352 3/20 0.56
LMNA P02545 3/20 0.56

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
Catechol SCHEMBL9720436 0.93 IDO1 (0.87) IDO1HPGDHSD17B10ALOX15RECQL
SCHEMBL4869305 0.93 IDO1 (0.73) IDO1HPGDHSD17B10ALOX15RECQL
SCHEMBL29638 0.93 IDO1 (1.00) IDO1HPGDHSD17B10ALOX15RECQL
SCHEMBL29362983 0.93 IDO1 (1.00) IDO1HPGDHSD17B10ALOX15RECQL
SCHEMBL29351230 0.93 IDO1 (0.73) IDO1HPGDHSD17B10ALOX15RECQL
SCHEMBL32677325 0.93 IDO1 (1.00) IDO1HPGDHSD17B10ALOX15RECQL
SCHEMBL28327 0.93 IDO1 (0.73) IDO1HPGDHSD17B10ALOX15RECQL
SCHEMBL28427946 0.90 IDO1 (0.69) IDO1HPGDHSD17B10ALOX15RECQL
SCHEMBL16107538 0.87 IDO1 (0.65) IDO1HPGDHSD17B10ALOX15RECQL
1-Naphthol SCHEMBL8119253 0.85 CYP1A2 (0.94) IDO1HPGDHSD17B10ALOX15RECQL

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-5153306-A AROMATIC POLYETHERS, FLUORESCENT RESIN COMPOSITIONS CONTAINING SAME, AND PROCESSES FOR PREPARING SAME IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-10-06 US disclosed