SCHEMBL11465645

SCHEMBL11465645

COc1ccc(CN2CCN(CCCCl)CC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.66
SMN1; SMN2 Q16637 1/20 0.59
CHKA P35790 1/20 0.58
HRH3 Q9Y5N1 3/20 0.57
ACHE P22303 1/20 0.56
RAD52 P43351 1/20 0.56

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
SCHEMBL10502107 0.92 SIGMAR1 (0.72) SIGMAR1SMN1; SMN2CHKAHRH3
SCHEMBL1043952 0.86 SIGMAR1 (0.85) SIGMAR1SMN1; SMN2CHKA
SCHEMBL20804352 0.86 SIGMAR1 (0.85) SIGMAR1SMN1; SMN2CHKA
SCHEMBL19285228 0.86 SIGMAR1 (0.85) SIGMAR1SMN1; SMN2CHKA
SCHEMBL11158126 0.86 SIGMAR1 (0.64) SIGMAR1SMN1; SMN2CHKA
SCHEMBL11352512 0.84 SIGMAR1 (0.74) SIGMAR1HRH3ACHE
SCHEMBL12126812 0.83 CHKA (0.79) SIGMAR1SMN1; SMN2CHKAHRH3
SCHEMBL10994325 0.83 HSD17B10 (0.73)
SCHEMBL23775600 0.82 SIGMAR1 (0.68) SIGMAR1SMN1; SMN2CHKAHRH3
SCHEMBL13256749 0.82 SIGMAR1 (0.68) SIGMAR1SMN1; SMN2CHKAHRH3

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
US-4234585-A ANTIALLERGENS, HYPOTENSIVE BOEHRINGER MANNHEIM GMBH (DE) 1980-11-18 US disclosed