SCHEMBL10679028

SCHEMBL10679028

CCN1CCN(CCCCCCOc2ccc(-c3ccccc3)cc2)CC1

nearest known ligand 0.89

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.89
MAPK1 P28482 1/20 0.89
HRH3 Q9Y5N1 13/20 0.74
KCNH2 Q12809 4/20 0.74
HRH4 Q9H3N8 3/20 0.74
NPC1 O15118 1/20 0.70
HRH1 P35367 2/20 0.66

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
SCHEMBL26383357 0.91 MAPK1 (0.73) RAB9AMAPK1
SCHEMBL6658840 0.90 RAB9A (0.86) RAB9AMAPK1HRH3KCNH2HRH4
SCHEMBL492265 0.87 HRH3 (0.97) HRH3KCNH2HRH4HRH1
SCHEMBL10676754 0.87 HRH3 (0.97) HRH3KCNH2HRH4HRH1
SCHEMBL5857700 0.85 HRH3 (0.94) HRH3KCNH2HRH4HRH1
SCHEMBL10679417 0.85 HRH3 (0.97) RAB9AMAPK1HRH3KCNH2HRH4
SCHEMBL20236177 0.81 RAB9A (0.62) RAB9AMAPK1HRH3NPC1
SCHEMBL11017523 0.81 ALDH1A1 (0.79) RAB9AMAPK1
SCHEMBL4094594 0.80 HRH3 (1.00) RAB9AMAPK1HRH3KCNH2HRH4
SCHEMBL10282319 0.80 MAPK1 (0.69) RAB9AMAPK1HRH1

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
US-4792570-A 3- and 4-biphenyloxyaminoalkanes and related compounds as anti-inflammatory and analgetic agents SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
EP-0157652-A1 2-, 3- And 4-biphenyloxyaminoalkanes and related compounds, their preparation and uses, and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1985-10-09 EP disclosed