SCHEMBL9770718

SCHEMBL9770718

Cc1cn2c(=O)c3c(C)cccc3nc2s1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
ELANE P08246 6/20 0.42
PARP1 P09874 1/20 0.42
PKM P14618 1/20 0.41
PIK3CD O00329 1/20 0.40
MAPT P10636 3/20 0.39
POLB P06746 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
PTGS2 P35354 2/20 0.39
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
RAB9A P51151 1/20 0.37
MAPK10 P53779 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CASR P41180 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
SCHEMBL9770716 0.86 PARP1 (0.44) KDM4EALDH1A1HPGDELANEPARP1
SCHEMBL9770658 0.86 KDM4E (0.46) KDM4EALDH1A1HPGDPARP1PKM
SCHEMBL10695218 0.86 ELANE (0.40) ELANEPARP1PIK3CDMAPTSMN1; SMN2
SCHEMBL9536653 0.86 ELANE (0.40) ELANEPARP1PIK3CDMAPTSMN1; SMN2
SCHEMBL10694401 0.83 ELANE (0.47) KDM4EALDH1A1HPGDELANEPKM
SCHEMBL10693610 0.79 KDM4E (0.54) KDM4EALDH1A1HPGDPKMMAPT
SCHEMBL10695623 0.77 KDM4E (0.51) KDM4EALDH1A1HPGDELANEPARP1
SCHEMBL9535141 0.77 CYP1A2 (0.50) HPGDELANEPARP1PKMPIK3CD
SCHEMBL9770665 0.73 ELANE (0.42) KDM4EALDH1A1HPGDELANEPARP1
SCHEMBL10697642 0.71 ELANE (0.40) KDM4EALDH1A1HPGDELANEPARP1

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