SCHEMBL23721197

SCHEMBL23721197

C=C(/C=C\C=C(/C)c1nncn1C1CC1)NC(=O)c1cc(-c2ccc(SCC(C)C)nc2)ccn1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 1/20 0.31
▸ MAP3K5 Q99683 1/20 0.31

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
SCHEMBL23720730 0.86 MAP3K5 (0.36) CBLBMAP3K5
SCHEMBL945431 0.74 MAP3K5 (0.56) CBLBMAP3K5
SCHEMBL17180505 0.74 MAP3K5 (0.41) CBLBMAP3K5
SCHEMBL23721196 0.73 MAP3K5 (0.34) CBLBMAP3K5
SCHEMBL22739074 0.72 MAP3K5 (0.43) MAP3K5
SCHEMBL17180512 0.72 MAP3K5 (0.53) CBLBMAP3K5
SCHEMBL22739085 0.72 MAP3K5 (0.30) MAP3K5
SCHEMBL22739290 0.70 EGFR (0.33) —
SCHEMBL22739020 0.66 — —
SCHEMBL23721179 0.64 CBLB (0.35) CBLBMAP3K5

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-3858824-A1 APOPTOSIS SIGNAL-REGULATING KINASE INHIBITORS Gilead Sciences, Inc. (US) 2021-08-04 — — EP disclosed
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