SCHEMBL9533606

SCHEMBL9533606

COc1cccc2c(=O)n3cc(Cl)sc3nc12

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TNKS O95271 6/20 0.43
TNKS2 Q9H2K2 6/20 0.43
PARP2 Q9UGN5 4/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 2/20 0.40
CYP1A1 P04798 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP1B1 Q16678 1/20 0.40
AKR1B1 P15121 1/20 0.40
APP P05067 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
PARP1 P09874 2/20 0.38
PDE10A Q9Y233 1/20 0.38
ADORA2A P29274 1/20 0.38
TRPA1 O75762 1/20 0.38
ACACA Q13085 1/20 0.38

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
SCHEMBL9535344 0.80 ELANE (0.43) TNKS2PARP2ALDH1A1KDM4EAPP
SCHEMBL9533817 0.77 TNKS (0.43) TNKSTNKS2PARP2ALDH1A1KDM4E
SCHEMBL9534241 0.76 PKM (0.50) TNKSTNKS2PARP2ALDH1A1KDM4E
SCHEMBL10695492 0.73 PARP1 (0.39) TNKSTNKS2PARP2ALDH1A1KDM4E
SCHEMBL10695759 0.73 CYP1A1 (0.43) TNKSTNKS2PARP2ALDH1A1KDM4E
SCHEMBL9770629 0.71 TNKS (0.42) TNKSTNKS2PARP2ALDH1A1KDM4E
SCHEMBL9536686 0.70 KDM4E (0.59) TNKSTNKS2PARP2ALDH1A1KDM4E
SCHEMBL10996994 0.70 TP53 (0.41) ALDH1A1KDM4ECYP1A2APPMAPT
SCHEMBL10695623 0.69 KDM4E (0.51) TNKSTNKS2PARP2ALDH1A1KDM4E
SCHEMBL9534683 0.68 PIK3R2 (0.37) AKR1B1

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
EP-0263523-B1 Process for the preparation of thiazolo [2,3-b] quinazolones BASF AG (DE) 1993-12-29 EP disclosed
EP-0263523-A2 Process for the preparation of thiazolo [2,3-b] quinazolones BASF Aktiengesellschaft (DE) 1988-04-13 EP disclosed