SCHEMBL21564582

SCHEMBL21564582

CN(Cc1cc(Cl)nc(Oc2ccc(N3CCC(NC(=O)OC(C)(C)C)CC3)nc2)c1)C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 1/20 0.45
▸ SKP1 P63208 1/20 0.45
▸ SKP2 Q13309 1/20 0.45
▸ MAPK8 P45983 1/20 0.41
▸ RET P07949 2/20 0.40
▸ SUV39H2 Q9H5I1 5/20 0.40
▸ SYK P43405 1/20 0.39
▸ FURIN P09958 6/20 0.38
▸ BTK Q06187 2/20 0.37
▸ JAK3 P52333 1/20 0.37
▸ PDE10A Q9Y233 1/20 0.36

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
SCHEMBL29891020 1.00 CKS1B (0.45) CKS1BSKP1SKP2MAPK8RET
SCHEMBL21553752 0.94 CKS1B (0.47) CKS1BSKP1SKP2MAPK8RET
SCHEMBL29890885 0.88 FURIN (0.47) CKS1BSKP1SKP2MAPK8RET
SCHEMBL21564580 0.87 CKS1B (0.47) CKS1BSKP1SKP2MAPK8RET
SCHEMBL21564562 0.86 CKS1B (0.44) CKS1BSKP1SKP2MAPK8RET
SCHEMBL29890729 0.86 CKS1B (0.44) CKS1BSKP1SKP2MAPK8RET
SCHEMBL21553754 0.85 CKS1B (0.46) CKS1BSKP1SKP2MAPK8RET
SCHEMBL28557733 0.84 CKS1B (0.50) CKS1BSKP1SKP2MAPK8RET
SCHEMBL21550916 0.82 FURIN (0.48) CKS1BSKP1SKP2MAPK8RET
SCHEMBL21551013 0.80 CKS1B (0.46) CKS1BSKP1SKP2MAPK8RET

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
WO-2019215341-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-14 — — WO disclosed
Send feedback