SCHEMBL6864521

SCHEMBL6864521

FC(F)C(F)(F)C(F)(F)c1cccc(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP19A1 P11511 2/20 0.38
KIF11 P52732 3/20 0.37
TSHR P16473 1/20 0.34
CETP P11597 1/20 0.34
CCR6 P51684 5/20 0.33
KCNH2 Q12809 3/20 0.33
OPRL1 P41146 1/20 0.33
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL5240455 0.79 ALDH1A1 (0.42) ALDH1A1MEN1CYP1A2CYP3A4CYP2D6
SCHEMBL19360439 0.78 ALDH1A1 (0.41) ALDH1A1MEN1CYP1A2CYP3A4CYP2D6
SCHEMBL6521774 0.77 ALDH1A1 (0.38) ALDH1A1MEN1CYP1A2CYP3A4CYP2D6
SCHEMBL2775197 0.77 TSHR (0.59) ALDH1A1MEN1CYP3A4MAPTKMT2A
SCHEMBL5014138 0.75 CYP19A1 (0.39) MEN1MAPTKMT2ACYP19A1TSHR
SCHEMBL592796 0.74 ALDH1A1 (0.58) ALDH1A1MEN1CYP1A2CYP3A4CYP2D6
SCHEMBL29635769 0.74 ALDH1A1 (0.58) ALDH1A1MEN1CYP1A2CYP3A4CYP2D6
SCHEMBL7870012 0.74 TSHR (0.48) ALDH1A1MEN1MAPTKMT2AKIF11
SCHEMBL1504946 0.73 ALDH1A1 (0.56) ALDH1A1MEN1CYP1A2CYP3A4CYP2D6
SCHEMBL28707337 0.73 ALDH1A1 (0.43) ALDH1A1MEN1CYP1A2CYP3A4CYP2D6

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-6794480-B2 POLYARYLENE-BASED COPOLYMER USEFUL AS PROTON-CONDUCTIVE MEMBRANE WHICH CAN BE USED AS ELECTRON FOR PRIMARY BATTERY, ELECTROLYTE FOR SECONDARY BATTERY, HIGH MOLECULAR SOLID ELECTROLYTE FOR FUEL CELL JSR CORPORATION (JP) 2004-09-21 US disclosed
US-20020177656-A1 Monomer containing electron-withdrawing group and electron-donative group, and copolymer and proton-conductive membrane comprising same JSR CORPORATION (JP) 2002-11-28 US disclosed