SCHEMBL9047618

SCHEMBL9047618

CC(=O)Nc1ncc(Sc2ncc[nH]2)s1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 18/20 0.49
CDK2 P24941 18/20 0.49
CDK4 P11802 10/20 0.49
CDK1 P06493 8/20 0.49
CCNE2 O96020 16/20 0.48
CCND1 P24385 9/20 0.47
CCNB2 O95067 7/20 0.47
CCNB1 P14635 7/20 0.47
CCNB3 Q8WWL7 7/20 0.47
CCND2 P30279 1/20 0.44
CCND3 P30281 1/20 0.44
GCK P35557 1/20 0.38
TXK P42681 1/20 0.38
JAK3 P52333 1/20 0.38
BTK Q06187 1/20 0.38
CDK5 Q00535 1/20 0.37

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
SCHEMBL9096131 0.82 CCNE1 (0.61) CCNE1CDK2CDK4CDK1CCNE2
SCHEMBL9048641 0.77 CCNE1 (0.54) CCNE1CDK2CDK4CDK1CCNE2
SCHEMBL9048380 0.76 CCNE1 (0.56) CCNE1CDK2CDK4CDK1CCNE2
SCHEMBL1342634 0.74 NPC1 (0.42) TXKJAK3BTK
SCHEMBL9426322 0.73 CCNE1 (0.53) CCNE1CDK2CDK4CDK1CCNE2
SCHEMBL5216840 0.73 CCNE1 (0.67) CCNE1CDK2CDK4CDK1CCNE2
SCHEMBL1341480 0.73 TSHR (0.38) CCNE1CDK2CDK4CDK1CCNE2
SCHEMBL9046620 0.73 CCNE1 (0.66) CCNE1CDK2CDK4CDK1CCNE2
SCHEMBL9050606 0.73 CCNE1 (0.56) CCNE1CDK2CDK4CDK1CCNE2
SCHEMBL9099254 0.72 CCNE1 (0.51) CCNE1CDK2CDK4CDK1CCNE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0412404-B1 Thiazole derivatives, processes for production thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1996-01-31 EP disclosed
US-5369107-A Thiazole derivatives, processes for production thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-29 US disclosed
US-5256675-A Antirheumatic agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-10-26 US disclosed
EP-0412404-A2 Thiazole derivatives, processes for production thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-02-13 EP disclosed