SCHEMBL30180828

SCHEMBL30180828

COc1ccc(CNc2nccc3c2c(-c2ccc(NC(=O)Nc4cc(C5(C(F)(F)F)CC5)no4)c(F)c2)cn3C2CC2)c(OC)c1

nearest known ligand 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NEK7 Q8TDX7 20/20 0.56

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
SCHEMBL23966757 1.00 NEK7 (0.56) NEK7
SCHEMBL24034173 0.90 NEK7 (0.44) NEK7
SCHEMBL29484469 0.82 NEK7 (0.75) NEK7
SCHEMBL23966747 0.82 NEK7 (0.75) NEK7
SCHEMBL30320620 0.81 NEK7 (0.40) NEK7
SCHEMBL24096584 0.81 NEK7 (0.40) NEK7
SCHEMBL30320639 0.80 NEK7 (0.48) NEK7
SCHEMBL24096709 0.80 NEK7 (0.48) NEK7
SCHEMBL27217639 0.79 NEK7 (0.44) NEK7
SCHEMBL23966804 0.77 CYP1A2 (0.42) —

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-4146348-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2023-03-15 — — EP disclosed
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