SCHEMBL10846692

SCHEMBL10846692

OCCOCCOCCN1CCC(=C2c3ccccc3CCc3ccccc32)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SETD7 Q8WTS6 3/20 0.54
▸ PTAFR P25105 1/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MAPT P10636 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ DRD2 P14416 5/20 0.44
▸ CHRM2 P08172 4/20 0.44
▸ HTR2A P28223 4/20 0.44
▸ ADRA1A P35348 4/20 0.44
▸ HRH1 P35367 4/20 0.44
▸ OPRK1 P41145 4/20 0.44
▸ HTR2B P41595 4/20 0.44
▸ KCNH2 Q12809 4/20 0.44
▸ DRD3 P35462 4/20 0.44
▸ ADRA2A P08913 3/20 0.44
▸ ADRA2B P18089 3/20 0.44
▸ ADRA2C P18825 3/20 0.44
▸ HTR7 P34969 3/20 0.44

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
SCHEMBL10962757 0.99 SETD7 (0.55) SETD7PTAFRMEN1KMT2AMAPT
SCHEMBL10962040 0.85 CHRM2 (0.57) SETD7MEN1KMT2AMAPTMAPK1
SCHEMBL10961042 0.83 ADRA2A (0.58) SETD7MEN1KMT2AMAPK1DRD2
SCHEMBL9718818 0.82 SETD7 (0.51) SETD7PTAFRMEN1KMT2AMAPT
SCHEMBL10846771 0.81 HRH1 (0.57) MEN1KMT2AMAPTMAPK1SMN1; SMN2
Etolotifen SCHEMBL2109044 0.81 DRD3 (0.68) SETD7MEN1KMT2AMAPTMAPK1
SCHEMBL10847545 0.81 PTAFR (0.44) SETD7PTAFRMEN1KMT2AMAPT
Etolotifen SCHEMBL10851254 0.80 DRD3 (0.67) SETD7MEN1KMT2AMAPTMAPK1
SCHEMBL10848583 0.80 DRD3 (0.52) SETD7MEN1KMT2AMAPTMAPK1
SCHEMBL10848598 0.80 DRD3 (0.52) SETD7MEN1KMT2AMAPTMAPK1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4609664-A ANTIALLERGIC SANDOZ LTD. (CH) 1986-09-02 — — US claimed
EP-0047226-B1 PIPERIDYLIDENE DERIVATIVES, THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANDOZ AG (CH) 1985-05-15 — — EP claimed
EP-0047226-A2 Piperidylidene derivatives, their production and pharmaceutical compositions containing them SANDOZ AG (CH) 1982-03-10 — — EP claimed
US-4609664-A ANTIALLERGIC SANDOZ LTD. (CH) 1986-09-02 — — US disclosed
EP-0047226-B1 PIPERIDYLIDENE DERIVATIVES, THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANDOZ AG (CH) 1985-05-15 — — EP disclosed
EP-0047226-A2 Piperidylidene derivatives, their production and pharmaceutical compositions containing them SANDOZ AG (CH) 1982-03-10 — — EP disclosed
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