SCHEMBL8562136

SCHEMBL8562136

CCCCCN1CCCC(OCCOC)C1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BCHE P06276 7/20 0.47
GNAI3 P08754 2/20 0.38
GNAO1 P09471 2/20 0.38
GNAI1 P63096 2/20 0.38
NPC1 O15118 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL12912123 0.84 BCHE (0.51) BCHEGNAI3GNAO1GNAI1
SCHEMBL24661418 0.84 CYP3A4 (0.41) NPC1L3MBTL1
SCHEMBL24661420 0.84 CYP3A4 (0.41) NPC1L3MBTL1
SCHEMBL9277201 0.81 GNAO1 (0.46) BCHEGNAI3GNAO1GNAI1
SCHEMBL771415 0.80 NPC1 (0.37) NPC1L3MBTL1
SCHEMBL12464724 0.80 NPC1 (0.41) NPC1L3MBTL1
SCHEMBL12911893 0.79 BCHE (0.45) BCHE
SCHEMBL14369074 0.77 SMN1; SMN2 (0.45) NPC1L3MBTL1
SCHEMBL22436112 0.77 SMN1; SMN2 (0.45) NPC1L3MBTL1
SCHEMBL14394397 0.76 CHRM5 (0.46) NPC1

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-0853615-A1 PIPERIDINE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 1998-07-22 EP disclosed
WO-1997010212-A1 PIPERIDINE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 1997-03-20 WO disclosed