SCHEMBL2633810

SCHEMBL2633810

Cc1nc([N+]2([C@H]3CCNC3)CCC[C@@H]2C)ccc1[N+](=O)[O-]

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 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
SCHEMBL2633782 0.81
SCHEMBL2633879 0.81
SCHEMBL2474736 0.80 MEN1 (0.36) SLC6A2SLC6A4
SCHEMBL2477347 0.80 MEN1 (0.36) SLC6A2SLC6A4
SCHEMBL2475397 0.80 MEN1 (0.36) SLC6A2SLC6A4
SCHEMBL2476024 0.80 MEN1 (0.36) SLC6A2SLC6A4
SCHEMBL2476694 0.80 MEN1 (0.36) SLC6A2SLC6A4
SCHEMBL2637013 0.79 PARP1 (0.36)
SCHEMBL2635293 0.75 ACHE (0.35) SLC6A2SLC6A4
SCHEMBL2637553 0.74 METAP2 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2569294-A1 SUBSTITUTED N-HETEROARYL BIPYRROLIDINE CARBOXAMIDES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-03-20 EP disclosed
EP-2569304-A1 SUBSTITUTED N-HETEROARYL SPIROLACTAM BIPYRROLIDINES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-03-20 EP disclosed
WO-2011143148-A1 SUBSTITUTED N-HETEROARYL SPIROLACTAM BIPYRROLIDINES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-11-17 WO disclosed
WO-2011143162-A1 SUBSTITUTED N-HETEROARYL BIPYRROLIDINE CARBOXAMIDES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-11-17 WO disclosed