SCHEMBL8300781

SCHEMBL8300781

CC1CCC(N)CCN1C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GNAI3 P08754 1/20 0.36
▸ GNAO1 P09471 1/20 0.36
▸ GNAI1 P63096 1/20 0.36

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
SCHEMBL8299319 0.88 CHRM2 (0.32) GNAI3GNAO1GNAI1
SCHEMBL108955 0.80 — —
SCHEMBL21940867 0.80 — —
SCHEMBL21940866 0.80 — —
SCHEMBL29044517 0.80 — —
SCHEMBL24150524 0.80 — —
SCHEMBL29044493 0.80 — —
Hydrochloric Acid SCHEMBL1992978 0.78 GNAI3 (0.35) GNAI3GNAO1GNAI1
Hydrochloric Acid SCHEMBL5324439 0.78 GNAI3 (0.35) GNAI3GNAO1GNAI1
SCHEMBL21188799 0.77 — —

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
WO-2005007641-A1 2-PYRIDINE ALKYNE DERIVATIVES USEFUL FOR TREATING PAIN EURO-CELTIQUE S.A. (LU) 2005-01-27 — — WO disclosed
Send feedback