SCHEMBL10957997

SCHEMBL10957997

Cc1sc(-c2ccncc2)nc1C(=O)N(C)C

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 9/20 0.61
▸ DBF4 Q9UBU7 9/20 0.61
▸ KMT2A Q03164 4/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ NLRP1 Q9C000 1/20 0.48
▸ MAPT P10636 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ HRH3 Q9Y5N1 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ IKBKE Q14164 3/20 0.44
▸ TBK1 Q9UHD2 3/20 0.44
▸ CCNE1 P24864 1/20 0.43
▸ CDK2 P24941 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
SCHEMBL10958521 0.82 CDC7 (0.46) CDC7DBF4KMT2AMEN1KDM4E
SCHEMBL10953772 0.81 TBK1 (0.59) CDC7DBF4KMT2AMEN1KDM4E
SCHEMBL10958051 0.81 CDC7 (0.57) CDC7DBF4KMT2AKDM4EALDH1A1
SCHEMBL10958203 0.80 CYP19A1 (0.42) CDC7DBF4IKBKETBK1
SCHEMBL22460192 0.77 CDC7 (0.67) CDC7DBF4KMT2AMEN1KDM4E
SCHEMBL10956261 0.76 TBK1 (0.50) CDC7DBF4KMT2AMEN1KDM4E
SCHEMBL11116425 0.72 CDC7 (0.56) CDC7DBF4KMT2AMEN1KDM4E
SCHEMBL1460034 0.72 CDC7 (0.56) CDC7DBF4
SCHEMBL13040000 0.71 MAP4K1 (0.36) CDC7DBF4ALDH1A1POLBNPC1
SCHEMBL10053593 0.71 CDC7 (0.51) CDC7DBF4KMT2AMEN1KDM4E

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
US-4528291-A 2-(4'-Pyridinyl)-thiazole compounds and their use in increasing cardiac contractility SCHERING CORPORATION (US) 1985-07-09 — — US disclosed
EP-0097323-A2 2-(4-Pyridyl)-thiazole derivatives SCHERING CORPORATION (US) 1984-01-04 — — EP disclosed
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