SCHEMBL21923095

SCHEMBL21923095

CCc1cccc(-c2ccc3ncnc(N)c3n2)c1

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 20/20 0.71

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
SCHEMBL15587256 0.88 MAP4K4 (0.69) MAP4K4
SCHEMBL15587989 0.87 MAP4K4 (0.78) MAP4K4
SCHEMBL15587774 0.83 MAP4K4 (1.00) MAP4K4
SCHEMBL21925379 0.83 MAP4K4 (0.71) MAP4K4
SCHEMBL18135276 0.82 MAP4K4 (0.72) MAP4K4
Hydrochloric Acid SCHEMBL18984684 0.82 MAP4K4 (0.98) MAP4K4
SCHEMBL15587258 0.81 MAP4K4 (1.00) MAP4K4
SCHEMBL15587252 0.81 MAP4K4 (1.00) MAP4K4
SCHEMBL31060266 0.81 MAP4K4 (1.00) MAP4K4
SCHEMBL15537852 0.81 MAP4K4 (0.85) MAP4K4

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-2855459-B1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2020-04-29 — — EP disclosed
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