SCHEMBL92070

SCHEMBL92070

COCc1ccccc1NC(=O)c1cc2ccccc2c(/N=N/c2ccc(C)cc2S(=O)(=O)O)c1O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
CYP1A2 P05177 2/20 0.50
MPL P40238 4/20 0.42
HIF1A Q16665 2/20 0.41
PHLPP2 Q6ZVD8 1/20 0.40
NQO2 P16083 1/20 0.39
ENPP2 Q13822 3/20 0.38
CTRC Q99895 1/20 0.38
KMT2A Q03164 5/20 0.37
MEN1 O00255 4/20 0.37
TDP1 Q9NUW8 2/20 0.37
POLB P06746 2/20 0.37
THRB P10828 2/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 2/20 0.37
USP2 O75604 1/20 0.36
KCNMA1 Q12791 1/20 0.36

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
SCHEMBL92163 0.87 ALDH1A1 (0.55) ALDH1A1CYP1A2MPLHIF1APHLPP2
SCHEMBL9289879 0.85 MRGPRX1 (0.51) ALDH1A1CYP1A2MPLKMT2APOLB
SCHEMBL14960078 0.82 ALDH1A1 (0.57) ALDH1A1CYP1A2MPLHIF1APHLPP2
SCHEMBL30802166 0.80 ALDH1A1 (0.53) ALDH1A1CYP1A2MPLHIF1APHLPP2
SCHEMBL30271586 0.79 ALDH1A1 (0.58) ALDH1A1CYP1A2MPLHIF1APHLPP2
SCHEMBL7858442 0.79 ALDH1A1 (0.58) ALDH1A1CYP1A2MPLHIF1APHLPP2
SCHEMBL7851260 0.79 ALDH1A1 (0.58) ALDH1A1CYP1A2MPLHIF1APHLPP2
SCHEMBL7851257 0.79 ALDH1A1 (0.58) ALDH1A1CYP1A2MPLHIF1APHLPP2
SCHEMBL7858440 0.79 ALDH1A1 (0.58) ALDH1A1CYP1A2MPLHIF1APHLPP2
SCHEMBL92057 0.79 ALDH1A1 (0.72) ALDH1A1CYP1A2MPLHIF1APHLPP2

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-8128848-B2 Diketopyrrolopyrrole pigment composition for use in color filters CLARIANT FINANCE (BVI) LIMITED (VG) 2012-03-06 US disclosed
US-20100219384-A1 Diketopyrrolopyrrole Pigment Composition For Use In Color Filters CLARIANT FINANCE (BVI) LIMITED (VG) 2010-09-02 US disclosed