SCHEMBL15041008

SCHEMBL15041008

CC(=O)c1cc2sc3cc(C(C)=O)sc3c2s1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.64
CLK1 P49759 1/20 0.46
DYRK1A Q13627 1/20 0.46
DYRK1B Q9Y463 1/20 0.46
ALDH1A1 P00352 5/20 0.40
LMNA P02545 4/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
TSHR P16473 3/20 0.40
HPGD P15428 3/20 0.40
MAPT P10636 3/20 0.40
GLA P06280 2/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
PNMT P11086 1/20 0.38
NPSR1 Q6W5P4 2/20 0.38
TP53 P04637 1/20 0.38
KDM4E B2RXH2 5/20 0.37
HTT P42858 2/20 0.36
MAPK1 P28482 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
SCHEMBL12391945 0.85 GPR35 (0.48) GPR35CLK1DYRK1ADYRK1BALDH1A1
SCHEMBL12606667 0.78 GPR35 (1.00) GPR35ALDH1A1LMNANPC1RAB9A
SCHEMBL12413279 0.77 GPR35 (0.40) GPR35CLK1DYRK1ADYRK1BALDH1A1
SCHEMBL10343794 0.73 GPR35 (0.37) GPR35CLK1DYRK1ADYRK1BALDH1A1
SCHEMBL20464056 0.71 GPR35 (0.52) GPR35ALDH1A1LMNANPC1RAB9A
SCHEMBL400786 0.71 GPR35 (0.52) GPR35ALDH1A1NPC1RAB9ATSHR
SCHEMBL8346793 0.70 GPR35 (0.69) GPR35CLK1DYRK1ADYRK1BALDH1A1
SCHEMBL12523488 0.69 CLK1 (0.36) GPR35CLK1DYRK1ADYRK1BALDH1A1
SCHEMBL12393160 0.69 GPR35 (0.77) GPR35ALDH1A1LMNANPC1RAB9A
SCHEMBL15041015 0.67 GPR35 (0.52) GPR35ALDH1A1LMNANPC1RAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2791275-B1 ORGANIC SENSITIZERS FOR UP-CONVERSION MERCK PATENT GMBH (DE) 2017-05-31 EP disclosed
US-20140358198-A1 ORGANIC SENSITIZERS FOR UP-CONVERSION MERCK PATENT GMBH (DE) 2014-12-04 US disclosed
US-20140358198-A1 ORGANIC SENSITIZERS FOR UP-CONVERSION MERCK PATENT GMBH (DE) 2014-12-04 US disclosed
WO-2013087162-A1 ORGANIC SENSITIZERS FOR UP-CONVERSION MERCK PATENT GMBH (DE) 2013-06-20 WO disclosed