SCHEMBL10690950

SCHEMBL10690950

Cc1cccc2cc3cccc(C)c3c(OCCCCN(C)C)c12

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 3/20 0.50
KDM4E B2RXH2 5/20 0.46
ALDH1A1 P00352 5/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
TDP1 Q9NUW8 1/20 0.43
MAPT P10636 1/20 0.41
HTR7 P34969 1/20 0.40
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
HRH3 Q9Y5N1 2/20 0.38
ATM Q13315 1/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37

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
SCHEMBL10694635 0.89 HTR1B (0.53) HTR1BKDM4EALDH1A1KMT2AMEN1
SCHEMBL10694997 0.84 KDM4E (0.40) KDM4EALDH1A1KMT2AMEN1CYP1A2
SCHEMBL10694297 0.82 HTR1B (0.55) HTR1BKDM4EALDH1A1KMT2AMEN1
SCHEMBL10693012 0.81 HTR1B (0.42) HTR1BKDM4EALDH1A1KMT2AMEN1
SCHEMBL10692959 0.80 HTR1B (0.56) HTR1BKDM4EALDH1A1KMT2AMEN1
SCHEMBL10693265 0.77 SLC6A4 (0.49) HTR1BKDM4EALDH1A1
SCHEMBL10695962 0.76 HTR1B (0.62) HTR1BKDM4EALDH1A1KMT2AMEN1
SCHEMBL10691295 0.75 HTR1B (0.60) HTR1BKDM4EALDH1A1KMT2AMEN1
SCHEMBL10692799 0.75 HTR1B (0.60) HTR1BKDM4EALDH1A1KMT2AMEN1
SCHEMBL10691756 0.75 HTR1B (0.60) HTR1BKDM4EALDH1A1KMT2AMEN1

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