SCHEMBL5669653

SCHEMBL5669653

FC(F)(F)C(F)(F)C(F)(F)[CH]c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.35
MAOB P27338 3/20 0.35
TSHR P16473 2/20 0.35
CYP2A6 P11509 1/20 0.35
NFE2L2 Q16236 4/20 0.34
LMNA P02545 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GRM4 Q14833 1/20 0.33
S1PR4 O95977 1/20 0.32
MAPT P10636 1/20 0.32
S1PR1 P21453 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CYP1A1 P04798 1/20 0.31
CYP1B1 Q16678 1/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
CYP19A1 P11511 1/20 0.30
MAOA P21397 1/20 0.30
TRPA1 O75762 1/20 0.30
ALOX5 P09917 1/20 0.30

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
SCHEMBL1119409 0.93 ALDH1A1 (0.33) ALDH1A1MAOBTSHRCYP2A6NFE2L2
SCHEMBL1119516 0.91 LMNA (0.33) ALDH1A1MAOBTSHRCYP2A6NFE2L2
SCHEMBL5670111 0.85 ALDH1A1 (0.38) ALDH1A1MAOBTSHRCYP2A6NFE2L2
SCHEMBL10415151 0.77 MAOB (0.42) ALDH1A1MAOBTSHRNFE2L2LMNA
SCHEMBL10415153 0.77 MAOB (0.42) ALDH1A1MAOBTSHRNFE2L2LMNA
SCHEMBL67469 0.74 ALDH1A1 (0.41) ALDH1A1MAOBTSHRCYP2A6NFE2L2
SCHEMBL5352063 0.71 MAOB (0.41) ALDH1A1MAOBTSHRNFE2L2LMNA
SCHEMBL10522046 0.71 MAOB (0.41) ALDH1A1MAOBTSHRNFE2L2LMNA
SCHEMBL17331000 0.70 ALDH1A1 (0.38) ALDH1A1MAOBTSHRCYP2A6NFE2L2
SCHEMBL9222592 0.70 MAOB (0.39) ALDH1A1MAOBTSHRNFE2L2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105764885-B The production method of acid and free-radical generating agent and acid and free radical 富士胶片和光纯药株式会社 2018-11-09 CN disclosed
CN-105764885-A Acid- and radical-generating agent and method for generating acid and radical 和光纯药工业株式会社 2016-07-13 CN disclosed
EP-1670446-A2 METHOD OF INHIBITING REMNANT LIPOPROTEIN PRODUCTION JAPAN TOBACCO INC. (JP) 2006-06-21 EP disclosed
WO-2005030185-A2 METHOD OF INHIBITING REMNANT LIPOPROTEIN PRODUCTION JAPAN TOBACCO INC. (JP) 2005-04-07 WO disclosed