SCHEMBL21259976

SCHEMBL21259976

CN(C(=O)[C@@H]1[C@@H](Cc2ccnc(N)c2)C(=O)N1C(N)=O)c1ccn(C)n1

nearest known ligand 0.82

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ F11 P03951 20/20 0.82

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
SCHEMBL21259557 0.90 F11 (1.00) F11
SCHEMBL25771508 0.84 F11 (0.93) F11
SCHEMBL25774562 0.84 F11 (0.81) F11
SCHEMBL21259619 0.84 F11 (1.00) F11
SCHEMBL23527670 0.84 F11 (1.00) F11
SCHEMBL21259769 0.83 F11 (1.00) F11
SCHEMBL20318762 0.83 F11 (0.57) F11
SCHEMBL20302389 0.83 F11 (0.57) F11
SCHEMBL23527548 0.82 F11 (0.85) F11
SCHEMBL23561143 0.82 F11 (0.86) F11

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
WO-2019156929-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS eXIthera Pharmaceuticals Inc. (US) 2019-08-15 — — WO disclosed
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