SCHEMBL21869658

SCHEMBL21869658

c1cnc2c(NSC3CC3)ccc(-c3ccncc3)c2c1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 13/20 0.62
▸ SKP2 Q13309 13/20 0.62
▸ GLO1 Q04760 7/20 0.46
▸ COMT P21964 1/20 0.39

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
SCHEMBL21869707 0.90 CKS1B (0.62) CKS1BSKP2GLO1COMT
SCHEMBL21869671 0.87 CKS1B (0.64) CKS1BSKP2GLO1
SCHEMBL17506541 0.77 CKS1B (1.00) CKS1BSKP2GLO1
SCHEMBL21869666 0.76 CKS1B (0.59) CKS1BSKP2GLO1
SCHEMBL17506532 0.73 CKS1B (0.82) CKS1BSKP2GLO1
SCHEMBL21869667 0.73 CKS1B (0.65) CKS1BSKP2GLO1
SCHEMBL21869715 0.71 CKS1B (0.64) CKS1BSKP2GLO1COMT
SCHEMBL21869705 0.69 CKS1B (0.68) CKS1BSKP2GLO1
SCHEMBL17506530 0.69 CKS1B (1.00) CKS1BSKP2GLO1
SCHEMBL21869643 0.68 CKS1B (0.59) CKS1BSKP2GLO1

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-3180328-B1 QUINOLINE DERIVATIVES USEFUL AS UBIQUITINATION INHIBITORS RIGEL PHARMACEUTICALS INC (US) 2020-03-18 — — EP disclosed
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