SCHEMBL28844840

SCHEMBL28844840

Nc1ccc(C(F)(C(F)F)C(F)(F)F)c(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.52
TSHR P16473 2/20 0.52
GLA P06280 1/20 0.52
POLB P06746 1/20 0.52
KIF11 P52732 3/20 0.41
AR P10275 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SRC P12931 1/20 0.36
HPGD P15428 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TLR9 Q9NR96 1/20 0.36
NR1H2 P55055 1/20 0.36
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
SCHEMBL28844869 0.80 CYP3A4 (0.42) GAATSHRGLAPOLBKIF11
SCHEMBL28844879 0.80 TSHR (0.38) GAATSHRGLAPOLBKIF11
SCHEMBL21496127 0.80 ALDH1A1 (0.42) GAATSHRGLAPOLBKIF11
SCHEMBL827884 0.80 TSHR (0.70) GAATSHRGLAPOLBKIF11
SCHEMBL29420085 0.80 TSHR (0.70) GAATSHRGLAPOLBKIF11
SCHEMBL28394734 0.77 TSHR (0.40) GAATSHRGLAPOLBAR
SCHEMBL7190999 0.76 GAA (0.59) GAATSHRGLAPOLBKIF11
SCHEMBL29937520 0.76 GAA (0.59) GAATSHRGLAPOLBKIF11
SCHEMBL28844798 0.76 GAA (0.42) GAATSHRGLAPOLBKDM4E
SCHEMBL28263740 0.73 GAA (0.55) GAATSHRGLAPOLBKIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107817649-B Photosensitive resin composition, polyamide resin and method for producing same, compound and method for producing same, cured film and method for producing same 东京应化工业株式会社 2022-09-16 CN disclosed