SCHEMBL23761964

SCHEMBL23761964

Cc1cccc2cc(N3CCC(C(=O)C(C)C)C3)ncc12

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 12/20 0.42
▸ SMO Q99835 2/20 0.39
▸ NOTUM Q6P988 2/20 0.38
▸ KDM2B Q8NHM5 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ L3MBTL1 Q9Y468 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
SCHEMBL23762133 0.88 CREBBP (0.45) CREBBPSMONOTUM
SCHEMBL19663332 0.85 CREBBP (0.55) CREBBPSMONOTUMKDM4ETP53
SCHEMBL19662999 0.85 CREBBP (0.55) CREBBPNOTUM
SCHEMBL19662984 0.79 CREBBP (0.47) CREBBPKDM4E
SCHEMBL23762011 0.79 CREBBP (0.47) CREBBPKDM4E
SCHEMBL19662787 0.79 CREBBP (0.47) CREBBP
SCHEMBL19662997 0.79 CREBBP (0.47) CREBBPKDM4E
SCHEMBL19662790 0.77 CREBBP (0.50) CREBBP
SCHEMBL23761896 0.76 CREBBP (0.49) CREBBP
SCHEMBL19662793 0.76 CREBBP (0.49) CREBBP

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-3464286-B1 PYRAZOLOPYRIDINE DERIVATIVES FOR THE TREATMENT OF CANCER GENENTECH INC (US) 2021-08-18 — — EP disclosed
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