SCHEMBL9536686

SCHEMBL9536686

COc1cccc2c(=O)n3c(C)csc3nc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.59
ALDH1A1 P00352 4/20 0.59
HPGD P15428 3/20 0.59
HSD17B10 Q99714 3/20 0.59
SMN1; SMN2 Q16637 1/20 0.49
RCE1 Q9Y256 1/20 0.49
TP53 P04637 1/20 0.46
GLA P06280 1/20 0.45
CYP1A1 P04798 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP1B1 Q16678 1/20 0.43
KMT2A Q03164 1/20 0.43
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42
TUBA3C P0DPH7 1/20 0.42
TUBA1B P68363 1/20 0.42
TUBA4A P68366 1/20 0.42
TUBB4B P68371 1/20 0.42
TUBB3 Q13509 1/20 0.42
TUBB2A Q13885 1/20 0.42

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
SCHEMBL9533007 0.86 ALDH1A1 (0.55) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL9532194 0.83 KDM4E (0.65) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL10696506 0.81 ALDH1A1 (0.62) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL9533336 0.81 KDM4E (0.62) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL10695759 0.79 CYP1A1 (0.43) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL9534712 0.79 KDM4E (0.59) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL9770629 0.77 TNKS (0.42) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL9533817 0.75 TNKS (0.43) KDM4EALDH1A1HPGDCYP1A1CYP1A2
SCHEMBL9534241 0.75 PKM (0.50) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL10978164 0.75 KDM4E (1.00) KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2

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