SCHEMBL10695350

SCHEMBL10695350

Cc1cccc2cc3ccccc3c(OCCCCCCCCCCCCCl)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
CYP1A2 P05177 4/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP2A6 P11509 2/20 0.37
POLB P06746 1/20 0.36
ERBB2 P04626 1/20 0.36
FYN P06241 1/20 0.36
MAOA P21397 1/20 0.36
ACHE P22303 1/20 0.36
AHR P35869 1/20 0.36
HTR1B P28222 3/20 0.36
SLC6A4 P31645 2/20 0.35
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35

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
SCHEMBL27603617 0.90 CNR1 (0.41) ALDH1A1CYP1A2HPGDHSD17B10KDM4E
SCHEMBL10693274 0.89 HTR1B (0.47) ALDH1A1CYP1A2HPGDHSD17B10KDM4E
SCHEMBL3694800 0.89 ALDH1A1 (0.41) ALDH1A1CYP1A2HPGDHSD17B10KDM4E
SCHEMBL10694997 0.88 KDM4E (0.40) ALDH1A1CYP1A2HPGDHSD17B10KDM4E
SCHEMBL10692538 0.87 ALDH1A1 (0.42) ALDH1A1CYP1A2HPGDHSD17B10KDM4E
SCHEMBL10694635 0.87 HTR1B (0.53) ALDH1A1CYP1A2HPGDHSD17B10KDM4E
SCHEMBL10693833 0.85 L3MBTL1 (0.47) CYP1A2L3MBTL1ERBB2FYNMAOA
SCHEMBL10694532 0.85 L3MBTL1 (0.47) CYP1A2L3MBTL1ERBB2FYNMAOA
SCHEMBL10693502 0.85 L3MBTL1 (0.47) CYP1A2L3MBTL1ERBB2FYNMAOA
SCHEMBL10692840 0.85 L3MBTL1 (0.47) CYP1A2L3MBTL1ERBB2FYNMAOA

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