SCHEMBL11117554

SCHEMBL11117554

Cc1sc(-c2ccncc2)nc1SC(N)=O

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 12/20 0.50
▸ DBF4 Q9UBU7 12/20 0.50
▸ CCNE1 P24864 2/20 0.50
▸ CDK2 P24941 2/20 0.50
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ NLRP1 Q9C000 1/20 0.48
▸ MAPT P10636 3/20 0.46
▸ POLB P06746 1/20 0.46
▸ IKBKE Q14164 1/20 0.44
▸ TBK1 Q9UHD2 1/20 0.44
▸ KLK7 P49862 1/20 0.43

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
SCHEMBL10953772 0.78 TBK1 (0.59) CDC7DBF4CCNE1CDK2MEN1
SCHEMBL11116625 0.75 CDC7 (0.49) CDC7DBF4CCNE1CDK2MEN1
SCHEMBL11114995 0.74 CDC7 (0.48) CDC7DBF4CCNE1CDK2KDM4E
SCHEMBL10956261 0.73 TBK1 (0.50) CDC7DBF4CCNE1CDK2MEN1
SCHEMBL5271748 0.72 CDC7 (0.69) CDC7DBF4CCNE1CDK2KDM4E
SCHEMBL1460034 0.72 CDC7 (0.56) CDC7DBF4
SCHEMBL10053593 0.71 CDC7 (0.51) CDC7DBF4MEN1KMT2AKDM4E
SCHEMBL11119189 0.71 CDC7 (0.47) CDC7DBF4CCNE1CDK2KDM4E
SCHEMBL10957997 0.70 CDC7 (0.61) CDC7DBF4CCNE1CDK2MEN1
SCHEMBL17383501 0.68 HRH3 (0.47) CDC7DBF4MEN1KMT2AKDM4E

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-0097323-A2 2-(4-Pyridyl)-thiazole derivatives SCHERING CORPORATION (US) 1984-01-04 — — EP disclosed
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