SCHEMBL6629065

SCHEMBL6629065

Clc1ccc(N2CC3C[C@H]2CN3)cn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 13/20 1.00
CHRNA4 P43681 13/20 1.00
CHRNB4 P30926 1/20 0.62
CHRNA3 P32297 1/20 0.62

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
SCHEMBL5037226 1.00 CHRNB2 (1.00) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL5374465 1.00 CHRNB2 (1.00) CHRNB2CHRNA4CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL7250932 0.98 CHRNB2 (0.97) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL5038459 0.88 CHRNB2 (0.79) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL5377778 0.88 CHRNB2 (0.79) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL5384913 0.85 CHRNB2 (0.74) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL5388777 0.85 CHRNB2 (1.00) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL5372528 0.85 CHRNB2 (1.00) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL5367882 0.85 CHRNB2 (1.00) CHRNB2CHRNA4CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL5036709 0.84 CHRNB2 (0.72) CHRNB2CHRNA4CHRNB4CHRNA3

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-1144413-B1 2,5-DIAZABICYCLO 2.2.1]HEPTANE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USES SANOFI SYNTHELABO (FR) 2004-03-17 EP disclosed
US-6635645-B1 Nicotinic receptors dysfunction SANOFI-SYNTHELABO (FR) 2003-10-21 US disclosed