SCHEMBL10691821

SCHEMBL10691821

COc1cccc2cc3cccc(OC)c3c(OCCCCN)c12

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.50
HTR1B P28222 2/20 0.47
LMNA P02545 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 1/20 0.43
MAPK1 P28482 3/20 0.42
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
HPGD P15428 4/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
HASPIN Q8TF76 2/20 0.40
DYRK2 Q92630 1/20 0.40
MAPT P10636 4/20 0.40
HTR2A P28223 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
SCHEMBL10688822 0.88 SMN1; SMN2 (0.53) SMN1; SMN2LMNAMEN1KMT2ANPC1
SCHEMBL10694297 0.82 HTR1B (0.55) SMN1; SMN2HTR1BLMNAMEN1KMT2A
SCHEMBL10693012 0.81 HTR1B (0.42) HTR1BLMNAMEN1KMT2AALDH1A1
SCHEMBL5988318 0.80 SMN1; SMN2 (0.71) SMN1; SMN2LMNAMEN1KMT2ANPC1
SCHEMBL12627536 0.76 SMN1; SMN2 (0.58) SMN1; SMN2LMNAMEN1KMT2ANPC1
SCHEMBL10693837 0.75 HEXA (0.52) SMN1; SMN2MEN1KMT2AALDH1A1CYP2D6
SCHEMBL12627539 0.74 MCHR1 (0.49) SMN1; SMN2HTR1BLMNAMEN1KMT2A
SCHEMBL7060496 0.73 L3MBTL1 (0.70) SMN1; SMN2HTR1BLMNAMEN1KMT2A
SCHEMBL12627502 0.73 MCHR1 (0.49) SMN1; SMN2HTR1BLMNAMEN1KMT2A
SCHEMBL11018305 0.72 TDP1 (0.50) SMN1; SMN2HTR1BLMNAMEN1KMT2A

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