SCHEMBL11113696

SCHEMBL11113696

O=C(O)c1sc(-c2ccncc2)nc1O

nearest known ligand 0.97

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 13/20 0.97
DBF4 Q9UBU7 13/20 0.97
CCNE1 P24864 3/20 0.62
CDK2 P24941 3/20 0.62
TRPM8 Q7Z2W7 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.50
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49
RAB9A P51151 1/20 0.49

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
SCHEMBL15048961 0.86 CDC7 (0.73) CDC7DBF4CCNE1CDK2TRPM8
SCHEMBL10958086 0.85 CDC7 (1.00) CDC7DBF4CCNE1CDK2
SCHEMBL15049359 0.81 RAB9A (0.69) CDC7DBF4TRPM8SMN1; SMN2KDM4E
SCHEMBL15048913 0.81 RAB9A (0.73) CDC7DBF4TRPM8SMN1; SMN2KDM4E
SCHEMBL15049252 0.81 CDC7 (0.67) CDC7DBF4TRPM8SMN1; SMN2KDM4E
SCHEMBL3328924 0.81 SMN1; SMN2 (0.76) CDC7DBF4CCNE1CDK2SMN1; SMN2
SCHEMBL17374874 0.81 CDC7 (0.68) CDC7DBF4CCNE1CDK2TRPM8
SCHEMBL16113884 0.79 CDC7 (1.00) CDC7DBF4CCNE1CDK2SMN1; SMN2
SCHEMBL27996876 0.79 CDC7 (0.63) CDC7DBF4CCNE1CDK2TRPM8
SCHEMBL27996905 0.78 CDC7 (0.61) CDC7DBF4TRPM8SMN1; SMN2KDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104220069-A Trpm8 antagonists DOMPE SPA 2014-12-17 CN claimed
CN-104220069-A Trpm8 antagonists DOMPE SPA 2014-12-17 CN disclosed
EP-0097323-A2 2-(4-Pyridyl)-thiazole derivatives SCHERING CORPORATION (US) 1984-01-04 EP disclosed