SCHEMBL4385506

SCHEMBL4385506

Cc1ccc([N+](=O)[O-])cc1NC(=O)Oc1ccc2c(C)cc(=O)oc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.58
ALPI P09923 1/20 0.58
KDM4E B2RXH2 11/20 0.58
ALDH1A1 P00352 11/20 0.58
GAA P10253 6/20 0.58
KMT2A Q03164 5/20 0.58
GLA P06280 4/20 0.58
MAPT P10636 3/20 0.58
THRB P10828 2/20 0.58
MEN1 O00255 2/20 0.58
LMNA P02545 1/20 0.58
HTT P42858 1/20 0.58
MAOB P27338 2/20 0.53
POLB P06746 2/20 0.51
PKM P14618 1/20 0.51
DUSP3 P51452 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
HPGD P15428 4/20 0.50
HSD17B10 Q99714 3/20 0.50
NPBWR1 P48145 1/20 0.50

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
SCHEMBL4379921 0.81 ALPL (0.52) ALPLALPIKDM4EALDH1A1GAA
SCHEMBL4381248 0.77 KMT2A (0.53) ALPLALPIKDM4EALDH1A1GAA
SCHEMBL6575989 0.77 ALDH1A1 (0.67) ALPLALPIKDM4EALDH1A1GAA
SCHEMBL4385143 0.76 KDM4E (0.63) KDM4EALDH1A1GAAKMT2AGLA
SCHEMBL30475420 0.75 GAA (0.58) KDM4EALDH1A1GAAKMT2AMAPT
SCHEMBL30475423 0.75 GAA (0.58) KDM4EALDH1A1GAAKMT2AMAPT
SCHEMBL25854658 0.74 GAA (0.55) ALDH1A1GAAKMT2AMAPTMEN1
SCHEMBL4386624 0.73 KDM4E (0.55) KDM4EALDH1A1GAAKMT2AGLA
SCHEMBL11137615 0.73 HTT (0.67) ALDH1A1KMT2AGLAMAPTMEN1
SCHEMBL335474 0.72 KDM4E (1.00) KDM4EALDH1A1GAAKMT2AGLA

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
US-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 US disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US disclosed