SCHEMBL14748924

SCHEMBL14748924

COc1cc2csc(-c3scc4cc(OC)c(OC)cc34)c2cc1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
EHMT2 Q96KQ7 1/20 0.38
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
KDM4E B2RXH2 3/20 0.37
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
MAOA P21397 1/20 0.36
CYP3A4 P08684 2/20 0.34
MAPT P10636 2/20 0.34
NQO1 P15559 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL11267308 0.71 ALDH1A1 (0.39) ALDH1A1EHMT2PDE4APDE4BPDE4C
SCHEMBL29368836 0.69 CYP3A4 (0.53) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL11496731 0.69 ALDH1A1 (0.63) ALDH1A1EHMT2PDE4APDE4BPDE4C
SCHEMBL1711296 0.69 CYP3A4 (0.53) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL2849376 0.69 ALDH1A1 (0.50) ALDH1A1EHMT2PDE4APDE4BPDE4C
SCHEMBL27751211 0.69 ALDH1A1 (0.50) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL2138144 0.67 ALDH1A1 (0.60) ALDH1A1EHMT2PDE4APDE4BPDE4C
SCHEMBL27765191 0.67 ALDH1A1 (0.60) ALDH1A1EHMT2PDE4APDE4BPDE4C
SCHEMBL7866768 0.66 ALDH1A1 (0.46) ALDH1A1EHMT2PDE4APDE4BPDE4C
SCHEMBL24175397 0.64 MAOA (0.47) ALDH1A1PDE3BPDE3AMAOACYP3A4

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-20130056074-A1 DYE-SENSITIZED SOLAR CELL AND PRODUCTION METHOD OF THE SAME KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2013-03-07 US disclosed
US-20130056074-A1 DYE-SENSITIZED SOLAR CELL AND PRODUCTION METHOD OF THE SAME KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2013-03-07 US disclosed