SCHEMBL10692959

SCHEMBL10692959

Cc1cccc2c(OCCCCN(C)C)c3ccccc3cc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 3/20 0.56
ALDH1A1 P00352 6/20 0.42
KDM4E B2RXH2 4/20 0.42
CYP1A2 P05177 3/20 0.42
KMT2A Q03164 3/20 0.42
CYP2D6 P10635 2/20 0.42
MEN1 O00255 2/20 0.42
TDP1 Q9NUW8 2/20 0.41
ABCB11 O95342 1/20 0.41
LMNA P02545 1/20 0.41
SCN1A P35498 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN3A Q9NY46 1/20 0.41
TNKS O95271 1/20 0.40
TOP2A P11388 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP2A6 P11509 1/20 0.39
MAPT P10636 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL10695962 0.87 HTR1B (0.62) HTR1BALDH1A1KDM4ECYP1A2KMT2A
SCHEMBL10694635 0.87 HTR1B (0.53) HTR1BALDH1A1KDM4ECYP1A2KMT2A
SCHEMBL10691756 0.86 HTR1B (0.60) HTR1BALDH1A1KDM4ECYP1A2KMT2A
SCHEMBL10691295 0.86 HTR1B (0.60) HTR1BALDH1A1KDM4ECYP1A2KMT2A
SCHEMBL10692799 0.86 HTR1B (0.60) HTR1BALDH1A1KDM4ECYP1A2KMT2A
SCHEMBL10692538 0.85 ALDH1A1 (0.42) HTR1BALDH1A1KDM4ECYP1A2HPGD
SCHEMBL10696007 0.83 HTR1B (0.45) HTR1BALDH1A1KDM4ECYP1A2HPGD
SCHEMBL10694848 0.82 HTR1B (0.61) HTR1BALDH1A1KDM4ECYP1A2CYP2D6
SCHEMBL10690950 0.80 HTR1B (0.50) HTR1BALDH1A1KDM4ECYP1A2KMT2A
SCHEMBL10693568 0.79 HTR1B (0.47) HTR1BALDH1A1KDM4ECYP1A2HPGD

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