SCHEMBL22421149

SCHEMBL22421149

CONc1cnn2c1C(=O)N(C(C)C)CCC2

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MAP3K14 Q99558 2/20 0.39
▸ KAT2B Q92831 9/20 0.35
▸ BPTF Q12830 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
SCHEMBL20939798 0.76 MAP3K14 (0.34) MAP3K14
SCHEMBL22421129 0.75 MAP3K14 (0.40) MAP3K14
SCHEMBL22421146 0.75 MAP3K14 (0.40) MAP3K14
SCHEMBL22421148 0.72 ALDH1A1 (0.33) MAP3K14
SCHEMBL20939184 0.68 MAP3K14 (0.33) MAP3K14
SCHEMBL22421168 0.68 NPC1 (0.54) MAP3K14KAT2B
SCHEMBL20939543 0.67 MAP3K14 (0.33) MAP3K14
SCHEMBL23005491 0.65 MAP3K14 (0.33) MAP3K14
SCHEMBL22421103 0.65 PRMT5 (0.39) MAP3K14KAT2B
SCHEMBL24026521 0.64 CACNA2D1 (0.36) MAP3K14

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-3478673-B1 CYANOINDOLINE DERIVATIVES AS NIK INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2020-09-16 — — EP disclosed
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