SCHEMBL10697642

SCHEMBL10697642

Cc1cccc2nc3sc(Br)c(C)n3c(=O)c12

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ELANE P08246 11/20 0.40
PARP1 P09874 1/20 0.40
PIK3CD O00329 2/20 0.39
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
NPC1 O15118 2/20 0.36
LMNA P02545 2/20 0.36
TP53 P04637 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
MAPK10 P53779 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CASR P41180 1/20 0.36
CTRB1 P17538 1/20 0.35
ENPP1 P22413 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
SCHEMBL10696516 0.86 PARP1 (0.43) ELANEPARP1PIK3CDKDM4EHPGD
SCHEMBL9770665 0.86 ELANE (0.42) ELANEPARP1PIK3CDKDM4EHPGD
SCHEMBL10680146 0.80 NPC1 (0.57) KDM4EHPGDHSD17B10NPC1LMNA
SCHEMBL10695331 0.78 PDE7A (0.43) ELANEPARP1KDM4EHPGDHSD17B10
SCHEMBL9533044 0.78 ELANE (0.40) ELANEPARP1PIK3CDKDM4EHPGD
SCHEMBL10695218 0.75 ELANE (0.40) ELANEPARP1PIK3CDNPC1LMNA
SCHEMBL9532203 0.74 KDM4E (0.65) ELANEPARP1PIK3CDKDM4EHPGD
SCHEMBL9535817 0.72 PARP1 (0.44) ELANEPARP1PIK3CDKDM4EHPGD
SCHEMBL10696099 0.72 PARP1 (0.44) ELANEPARP1PIK3CDKDM4EHPGD
SCHEMBL10695051 0.72 TP53 (0.46) PARP1KDM4EHPGDHSD17B10NPC1

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-0263523-A2 Process for the preparation of thiazolo [2,3-b] quinazolones BASF Aktiengesellschaft (DE) 1988-04-13 EP disclosed