SCHEMBL20344575

SCHEMBL20344575

C/C(=C/C(=N)C(=O)N[C@H]1CCc2ccccc2N(C)C1=O)NCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 6/20 0.53
▸ SCN9A Q15858 1/20 0.49
▸ XIAP P98170 8/20 0.47
▸ PYGL P06737 1/20 0.45
▸ PYGM P11217 1/20 0.45
▸ MTNR1A P48039 1/20 0.43
▸ MME P08473 2/20 0.42
▸ ACE P12821 2/20 0.42

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
SCHEMBL31655855 0.85 RIPK1 (0.60) RIPK1SCN9AXIAPPYGLPYGM
SCHEMBL20344528 0.83 RIPK1 (0.57) RIPK1
SCHEMBL31655974 0.77 RIPK1 (0.58) RIPK1SCN9AXIAPPYGLPYGM
SCHEMBL3924251 0.75 RIPK1 (0.63) RIPK1SCN9AXIAPPYGLPYGM
SCHEMBL4218830 0.75 RIPK1 (0.63) RIPK1SCN9AXIAPPYGLPYGM
SCHEMBL14376829 0.75 RIPK1 (0.60) RIPK1SCN9AXIAPPYGLPYGM
SCHEMBL17312498 0.71 RIPK1 (0.66) RIPK1SCN9APYGLPYGM
SCHEMBL17312496 0.71 RIPK1 (0.66) RIPK1SCN9APYGLPYGM
SCHEMBL19017810 0.70 ACHE (0.43) —
SCHEMBL17312552 0.70 RIPK1 (0.77) RIPK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3342771-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-11-25 — — EP disclosed
EP-3508484-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2019-07-10 — — EP disclosed
EP-3342771-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2018-07-04 — — EP disclosed
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