SCHEMBL10719982

SCHEMBL10719982

Nc1cccc(Sc2ccc([C@@H]3CC[C@H]4CCCCN43)cc2)c1

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.64
ANXA2 P07355 1/20 0.33
S100A10 P60903 1/20 0.33
CRBN Q96SW2 1/20 0.32
HTR2C P28335 2/20 0.32

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
SCHEMBL10718703 1.00 HRH3 (0.64) HRH3ANXA2S100A10CRBNHTR2C
SCHEMBL10719966 1.00 HRH3 (0.64) HRH3ANXA2S100A10CRBNHTR2C
SCHEMBL4301727 0.87 HRH3 (0.73) HRH3
SCHEMBL4301730 0.87 HRH3 (0.73) HRH3
SCHEMBL7025858 0.87 HRH3 (0.73) HRH3
SCHEMBL4301735 0.87 HRH3 (0.73) HRH3
SCHEMBL13660563 0.81 HRH3 (0.68) HRH3
SCHEMBL4294096 0.81 HRH3 (0.48) HRH3
SCHEMBL13660566 0.81 HRH3 (0.48) HRH3
SCHEMBL10721503 0.79 HRH3 (0.73) HRH3

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-0241298-A2 3-diphenyl substituted octahydroindolizine analgesic compounds McNeilab, Inc. (US) 1987-10-14 EP disclosed
US-4683239-A 3-diphenyl substituted octahydroindolizine analgesic compounds MCNEILAB, INC. (US) 1987-07-28 US disclosed