SCHEMBL2466022

SCHEMBL2466022

Nc1ccc2ccccc2c1O.Nc1cccc2ccc(O)cc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
HPGD P15428 3/20 0.52
CYP3A4 P08684 2/20 0.52
TSHR P16473 2/20 0.52
HSD17B10 Q99714 2/20 0.52
KEAP1 Q14145 1/20 0.52
F2 P00734 1/20 0.47
PLG P00747 1/20 0.47
PLAU P00749 1/20 0.47
PLAT P00750 1/20 0.47
KLK1 P06870 1/20 0.47
PRSS1 P07477 1/20 0.47
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 2/20 0.45
POLB P06746 2/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
TDP2 O95551 1/20 0.45
MAPT P10636 1/20 0.45
CASP6 P55212 1/20 0.45

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
SCHEMBL208278 0.88 F2 (0.58) ALDH1A1HPGDCYP3A4TSHRHSD17B10
SCHEMBL29792935 0.88 F2 (0.58) ALDH1A1HPGDCYP3A4TSHRHSD17B10
SCHEMBL8001257 0.88 F2 (0.58) ALDH1A1HPGDCYP3A4TSHRHSD17B10
Hydroquinone SCHEMBL9776726 0.86 F2 (0.56) ALDH1A1HPGDCYP3A4TSHRHSD17B10
SCHEMBL29164286 0.86 F2 (0.56) ALDH1A1HPGDCYP3A4TSHRHSD17B10
SCHEMBL29394466 0.86 F2 (0.56) ALDH1A1HPGDCYP3A4TSHRHSD17B10
SCHEMBL7991025 0.85 IDO1 (0.61) ALDH1A1HPGDCYP3A4TSHRHSD17B10
SCHEMBL8003535 0.84 PTPN22 (0.60) ALDH1A1HPGDCYP3A4TSHRHSD17B10
SCHEMBL30168079 0.84 PTPN22 (0.60) ALDH1A1HPGDCYP3A4TSHRHSD17B10
Hydrochloric Acid SCHEMBL29399146 0.84 PTPN22 (0.60) ALDH1A1HPGDCYP3A4TSHRHSD17B10

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
EP-1862855-B1 PHOTOSENSITIVE RESIN COMPOSITION TORAY INDUSTRIES (JP) 2011-10-05 EP disclosed