SCHEMBL9852615

SCHEMBL9852615

CCOC(=O)c1sc(-c2ccccc2)nc1Oc1ccccc1C(F)(F)F

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 6/20 0.59
CDC7 O00311 6/20 0.59
DBF4 Q9UBU7 6/20 0.59
MEN1 O00255 2/20 0.54
MAPT P10636 2/20 0.54
KMT2A Q03164 2/20 0.54
KDM4E B2RXH2 1/20 0.54
HSP90AA1 P07900 1/20 0.54
CRHBP P24387 1/20 0.54
CRHR2 Q13324 1/20 0.54
P2RY1 P47900 1/20 0.49
ALOX5 P09917 1/20 0.48
DHODH Q02127 3/20 0.47
RARA P10276 1/20 0.47
RARB P10826 1/20 0.47
RARG P13631 1/20 0.47

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
SCHEMBL9795516 0.83 CDC7 (0.52) TRPM8CDC7DBF4MEN1MAPT
SCHEMBL9795475 0.81 MAPT (0.65) TRPM8CDC7DBF4MEN1MAPT
SCHEMBL5641718 0.80 CDC7 (0.68) TRPM8CDC7DBF4MEN1MAPT
SCHEMBL9795379 0.80 TRPM8 (0.48) TRPM8CDC7DBF4MEN1MAPT
SCHEMBL6336462 0.80 CDC7 (0.61) TRPM8CDC7DBF4MEN1MAPT
SCHEMBL4163787 0.80 CDC7 (0.79) TRPM8CDC7DBF4MAPTALOX5
SCHEMBL15049067 0.79 MAPT (0.50) TRPM8CDC7DBF4MEN1MAPT
SCHEMBL15049187 0.79 MEN1 (0.63) TRPM8CDC7DBF4MEN1MAPT
SCHEMBL15049221 0.79 MEN1 (0.63) TRPM8CDC7DBF4MEN1MAPT
SCHEMBL15049029 0.77 CDC7 (0.67) TRPM8CDC7DBF4MAPTALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0422470-A2 Thiazolcarboxylic acid amide derivatives BAYER AG (DE) 1991-04-17 EP disclosed