SCHEMBL21564562

SCHEMBL21564562

CN(Cc1cc(Oc2ccc(N3CCC(NC(=O)OC(C)(C)C)CC3)nc2)cc(-c2cc(Cl)cc(Cl)c2)c1)C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 2/20 0.44
▸ SKP1 P63208 2/20 0.44
▸ SKP2 Q13309 2/20 0.44
▸ MAPK8 P45983 1/20 0.42
▸ RET P07949 4/20 0.41
▸ SYK P43405 1/20 0.38
▸ FURIN P09958 6/20 0.38
▸ SUV39H2 Q9H5I1 3/20 0.37
▸ BTK Q06187 1/20 0.37
▸ CNR1 P21554 1/20 0.35
▸ CNR2 P34972 1/20 0.35

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
SCHEMBL29890729 1.00 CKS1B (0.44) CKS1BSKP1SKP2MAPK8RET
SCHEMBL21551013 0.94 CKS1B (0.46) CKS1BSKP1SKP2MAPK8RET
SCHEMBL21564582 0.86 CKS1B (0.45) CKS1BSKP1SKP2MAPK8RET
SCHEMBL29891020 0.86 CKS1B (0.45) CKS1BSKP1SKP2MAPK8RET
SCHEMBL21551015 0.86 CKS1B (0.44) CKS1BSKP1SKP2MAPK8RET
SCHEMBL29890885 0.85 FURIN (0.47) CKS1BSKP1SKP2MAPK8RET
SCHEMBL28539414 0.85 CKS1B (0.48) CKS1BSKP1SKP2MAPK8RET
SCHEMBL21553752 0.80 CKS1B (0.47) CKS1BSKP1SKP2MAPK8RET
SCHEMBL21550916 0.80 FURIN (0.48) CKS1BSKP1SKP2MAPK8RET
SCHEMBL30931855 0.79 HTR2C (0.35) —

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
EP-3790871-B1 FURIN INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-01-24 — — EP disclosed
WO-2019215341-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-14 — — WO disclosed
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