SCHEMBL29824

SCHEMBL29824

NC(=O)C1CNCc2cccn21

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 1/20 0.32
▸ ELANE P08246 2/20 0.30
▸ LMNA P02545 1/20 0.30

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
SCHEMBL23387 0.85 NOTUM (0.33) —
SCHEMBL14845189 0.77 HSD17B10 (0.31) —
SCHEMBL8584156 0.75 AR (0.33) ARELANE
SCHEMBL15562802 0.72 FFAR1 (0.35) —
SCHEMBL14911074 0.71 ALDH1A1 (0.33) LMNA
SCHEMBL19067224 0.69 HTR2A (0.42) —
SCHEMBL4238187 0.64 SLC6A4 (0.50) —
SCHEMBL21360355 0.64 SLC6A4 (0.50) —
SCHEMBL20140984 0.64 SLC6A4 (0.50) —
SCHEMBL1083195 0.62 ALDH1A1 (0.37) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2588480-A2 3,4-DIHYDROPYRROLO[1,2-A]PYRAZINE-2,8(1H)-DICARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF& xA; SANOFI (FR) 2013-05-08 — — EP disclosed
WO-2011161537-A2 3,4-DIHYDROPYRROLO[1,2-A]PYRAZINE-2,8(1H)-DICARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-12-29 — — WO disclosed
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