SCHEMBL19670396

SCHEMBL19670396

CCN1CC[C@@H](C)N(C(=O)Nc2cnccn2)c2nc(-c3ccnc(N4CC[C@@H](F)C4)c3)ccc21

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KARS1 Q15046 15/20 0.40
▸ PRKD1 Q15139 4/20 0.34
▸ DYRK1A Q13627 1/20 0.34

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
SCHEMBL19670487 1.00 KARS1 (0.40) KARS1PRKD1DYRK1A
SCHEMBL19670006 0.91 KARS1 (0.40) KARS1PRKD1DYRK1A
SCHEMBL19669950 0.89 KARS1 (0.34) KARS1DYRK1A
SCHEMBL19669954 0.89 KARS1 (0.34) KARS1DYRK1A
SCHEMBL19670507 0.87 KARS1 (0.34) KARS1DYRK1A
SCHEMBL19670514 0.87 KARS1 (0.34) KARS1DYRK1A
SCHEMBL19670631 0.86 FAAH (0.35) KARS1
SCHEMBL17618680 0.84 KARS1 (0.42) KARS1PRKD1
SCHEMBL17618657 0.84 KARS1 (0.42) KARS1PRKD1
SCHEMBL19365562 0.83 MTOR (0.41) DYRK1A

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
US-9834558-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-12-05 — — US disclosed
Send feedback