SCHEMBL31065003

SCHEMBL31065003

Oc1cccc(-c2cc3cccnc3[nH]2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 18/20 1.00
▸ CCNB2 O95067 2/20 0.66
▸ CDK1 P06493 2/20 0.66
▸ CCNB1 P14635 2/20 0.66
▸ CCNB3 Q8WWL7 2/20 0.66
▸ CDC7 O00311 1/20 0.51

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
SCHEMBL14115574 1.00 RIPK1 (1.00) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL18741322 0.84 RIPK1 (1.00) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL1778505 0.82 RIPK1 (0.74) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL1780991 0.79 CYP19A1 (0.66) RIPK1CCNB2CDK1CCNB1CCNB3
Bromide SCHEMBL490969 0.78 CCNB2 (0.97) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL31064955 0.78 RIPK1 (1.00) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL28043442 0.78 RIPK1 (0.74) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL31065008 0.78 RIPK1 (1.00) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL26053438 0.77 RIPK1 (0.71) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL31064968 0.77 RIPK1 (0.63) RIPK1CCNB2CDK1CCNB1CCNB3

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
CN-118344359-A RIPK1 kinase targeted inhibitor and application thereof 中国药科大学 2024-07-16 — — CN disclosed
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