SCHEMBL9770665

SCHEMBL9770665

Cc1sc2nc3cccc(C)c3c(=O)n2c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.42
PARP1 P09874 1/20 0.42
PKM P14618 1/20 0.41
PIK3CD O00329 1/20 0.40
TP53 P04637 4/20 0.40
TDP1 Q9NUW8 1/20 0.40
PTGS2 P35354 1/20 0.39
MAPT P10636 2/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
NPC1 O15118 2/20 0.38
LMNA P02545 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK10 P53779 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CASR P41180 1/20 0.37
DCTPP1 Q9H773 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
SCHEMBL10695051 0.86 TP53 (0.46) PARP1PKMTP53TDP1PTGS2
SCHEMBL10696099 0.86 PARP1 (0.44) ELANEPARP1PKMPIK3CDTP53
SCHEMBL10697642 0.86 ELANE (0.40) ELANEPARP1PIK3CDTP53MAPT
SCHEMBL10694920 0.83 ELANE (0.47) ELANEPKMMAPTKDM4EHPGD
SCHEMBL9533044 0.80 ELANE (0.40) ELANEPARP1PIK3CDTP53PTGS2
SCHEMBL10694328 0.77 ELANE (0.42) ELANEPARP1TP53TDP1MAPT
SCHEMBL9532203 0.77 KDM4E (0.65) ELANEPARP1PKMPIK3CDTP53
SCHEMBL9535817 0.74 PARP1 (0.44) ELANEPARP1PIK3CDTP53MAPT
SCHEMBL9770718 0.73 KDM4E (0.45) ELANEPARP1PKMPIK3CDTP53
SCHEMBL10696516 0.72 PARP1 (0.43) ELANEPARP1PIK3CDTP53MAPT

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-5030727-A Reacting an anthronilide derivative with a thiazole derivative or a fluorozuinazolone with a neucleophile BASF AKTIENGESELLSCHAFT (DE) 1991-07-09 US disclosed
EP-0263523-A2 Process for the preparation of thiazolo [2,3-b] quinazolones BASF Aktiengesellschaft (DE) 1988-04-13 EP disclosed