SCHEMBL10694841

SCHEMBL10694841

O=C1c2ccccc2Cc2cc(Cl)ccc21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.67
METAP1 P53582 1/20 0.61
S100A4 P26447 2/20 0.53
ITGA1 P56199 1/20 0.52
CES1 P23141 2/20 0.52
BCHE P06276 1/20 0.52
CYP1A2 P05177 2/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CASP6 P55212 1/20 0.46
HSP90AA1 P07900 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SRD5A2 P31213 1/20 0.46

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
SCHEMBL6899110 0.93 MAOA (0.67) MAOAMETAP1S100A4ITGA1CES1
SCHEMBL10691369 0.90 METAP1 (0.71) MAOAMETAP1S100A4CES1HSP90AA1
SCHEMBL6905130 0.89 METAP1 (0.65) MAOAMETAP1S100A4ITGA1CES1
SCHEMBL1921628 0.88 KDM4E (0.59) MAOAMETAP1S100A4ITGA1CYP1A2
SCHEMBL11145884 0.86 MAOA (0.57) MAOAMETAP1S100A4ITGA1CES1
SCHEMBL4135475 0.85 CES1 (0.61) MAOAMETAP1S100A4CES1TDP1
SCHEMBL5021694 0.82 MAOA (0.82) MAOACES1BCHECYP1A2KDM4E
Anthrone SCHEMBL1527782 0.82 MAOA (1.00) MAOACES1BCHECYP1A2KDM4E
Anthrone SCHEMBL29448801 0.82 MAOA (1.00) MAOACES1BCHECYP1A2KDM4E
Anthrone SCHEMBL29357010 0.82 MAOA (1.00) MAOACES1BCHECYP1A2KDM4E

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