SCHEMBL10694029

SCHEMBL10694029

COc1ccc2cc3ccccc3c(OCCCCCCCCCN(C)C)c2c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.49
HTR1B P28222 2/20 0.49
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
SIGMAR1 Q99720 6/20 0.42
TERT O14746 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SLC6A4 P31645 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2A6 P11509 1/20 0.41

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
SCHEMBL10693307 0.91 HTR1B (0.50) HTR2AHTR1BMAOAMAOBTERT
SCHEMBL10691295 0.88 HTR1B (0.60) HTR1BSIGMAR1KDM4EALDH1A1CYP1A2
SCHEMBL10691756 0.88 HTR1B (0.60) HTR1BSIGMAR1KDM4EALDH1A1CYP1A2
SCHEMBL10692799 0.88 HTR1B (0.60) HTR1BSIGMAR1KDM4EALDH1A1CYP1A2
SCHEMBL10692825 0.88 MAOB (0.46) HTR2AMAOAMAOBKDM4EALDH1A1
SCHEMBL10695962 0.87 HTR1B (0.62) HTR1BKDM4EALDH1A1CYP1A2
SCHEMBL10693321 0.86 CYP1A2 (0.44) HTR2AKDM4EALDH1A1CYP1A2CYP2A6
SCHEMBL10688770 0.85 CYP1A2 (0.42) HTR1BSIGMAR1CYP1A2CYP2A6
SCHEMBL10694848 0.82 HTR1B (0.61) HTR1BKDM4EALDH1A1CYP1A2
SCHEMBL10690312 0.82 HTR1B (0.51) HTR1BKDM4ESLC6A4CYP1A2

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-4792551-A 9-anthryloxyaminoalkanes and related compounds as anti-inflammatory and analgetic agents SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
EP-0132351-A2 9-Anthryloxyaminoalkanes and related compounds, processes for their preparation and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1985-01-30 EP disclosed