SCHEMBL30152040

SCHEMBL30152040

Brc1cccc(-c2cccc3c2sc2ccccc23)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.61
PARP14 Q460N5 1/20 0.43
PRKDC P78527 3/20 0.42
EGFR P00533 1/20 0.42
TDO2 P48775 1/20 0.41
GPR3 P46089 1/20 0.41
MAOB P27338 2/20 0.40
MAOA P21397 1/20 0.40
TNKS O95271 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
PIK3CD O00329 1/20 0.38
BRD4 O60885 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
MTOR P42345 1/20 0.38
PIK3CG P48736 1/20 0.38
KCNH2 Q12809 1/20 0.38
BRDT Q58F21 1/20 0.38
F9 P00740 1/20 0.37
GABRP O00591 1/20 0.37

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
SCHEMBL1278381 1.00 ALOX5 (0.61) ALOX5PARP14PRKDCEGFRTDO2
Bromide SCHEMBL28127262 0.98 ALOX5 (0.60) ALOX5PARP14PRKDCEGFRTDO2
SCHEMBL29489064 0.97 ALOX5 (0.58) ALOX5PARP14PRKDCEGFRTDO2
SCHEMBL1278213 0.97 ALOX5 (0.58) ALOX5PARP14PRKDCEGFRTDO2
SCHEMBL27958802 0.94 ALOX5 (0.55) ALOX5PARP14PRKDCEGFRTDO2
SCHEMBL29489091 0.92 ALOX5 (0.57) ALOX5PARP14PRKDCEGFRTDO2
SCHEMBL17383078 0.92 ALOX5 (0.57) ALOX5PARP14PRKDCEGFRTDO2
SCHEMBL25833469 0.91 ALOX5 (0.56) ALOX5PARP14PRKDCEGFRTDO2
SCHEMBL14814297 0.89 ALOX5 (0.59) ALOX5PARP14PRKDCEGFRTDO2
SCHEMBL12996531 0.88 ALOX5 (0.71) ALOX5PARP14PRKDCGPR3TNKS

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-3820965-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-01-25 EP disclosed