SCHEMBL16601774

SCHEMBL16601774

O=C1c2cccc(CCO)c2C(=O)c2c(-c3ccc(F)cc3)ccc(-c3ccc(F)cc3)c21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.42
ADORA1 P30542 2/20 0.42
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
PTGS2 P35354 4/20 0.36
PTGS1 P23219 2/20 0.36
MEN1 O00255 1/20 0.35
PABPC1 P11940 1/20 0.35
KMT2A Q03164 1/20 0.35
ELANE P08246 6/20 0.35
CTSG P08311 4/20 0.35
MAOA P21397 2/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
MAOB P27338 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL2313485 0.83 MAOA (0.48) ADORA2AMEN1PABPC1KMT2AELANE
SCHEMBL2311538 0.81 MAOA (0.50) ADORA2AMEN1PABPC1KMT2AELANE
SCHEMBL16601839 0.81 BACE1 (0.43) MEN1PABPC1KMT2AELANECTSG
SCHEMBL15764237 0.80 KMT2A (0.43) ADORA2AADORA1MEN1PABPC1KMT2A
SCHEMBL16656211 0.79 MAOA (0.61) MEN1KMT2AELANECTSGMAOA
SCHEMBL2316204 0.78 MEN1 (0.54) ADORA2AMEN1PABPC1KMT2AELANE
SCHEMBL29393629 0.76 ADORA2A (0.52) ADORA2AMEN1PABPC1KMT2AMAOA
SCHEMBL124078 0.76 ADORA2A (0.52) ADORA2AMEN1PABPC1KMT2AMAOA
SCHEMBL16656182 0.76 PTGS2 (0.42) ADORA2AADORA1PTGS2PTGS1ELANE
SCHEMBL16656213 0.75 MAOA (0.66) MEN1KMT2AELANECTSGMAOA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed