SCHEMBL14934147

SCHEMBL14934147

Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1S

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 3/20 0.35
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KIF11 P52732 3/20 0.34
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
GFER P55789 1/20 0.33
KMT2A Q03164 1/20 0.33
PTPN5 P54829 2/20 0.32
CFTR P13569 1/20 0.32
BACE1 P56817 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NOS3 P29474 1/20 0.31
NOS2 P35228 1/20 0.31

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
SCHEMBL30532274 0.85 ALDH1A1 (0.47) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL2788945 0.85 ALDH1A1 (0.47) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL718187 0.83 ESR1 (0.40) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL6757387 0.83 ALDH1A1 (0.37) ALDH1A1KDM4EPKMHPGDHSD17B10
Hydrochloric Acid SCHEMBL4183751 0.83 ALDH1A1 (0.46) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL5958675 0.80 ALDH1A1 (0.41) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL11245521 0.80 AR (0.46) ALDH1A1KDM4EHPGDHSD17B10TSHR
SCHEMBL29395047 0.79 FFAR4 (0.41) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL1766291 0.79 FFAR4 (0.41) ALDH1A1KDM4EPKMHPGDHSD17B10
SCHEMBL8510672 0.79 ESR1 (0.36) ALDH1A1KDM4EPKMHPGDHSD17B10

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
CN-104024222-A PHTHALAMIDE DERIVATIVE, PESTICIDE FOR AGRICULTURAL AND HORTICULTURAL APPLICATIONS WHICH COMPRISES SAID DERIVATIVE, AND METHOD OF UTILIZING SAID PESTICIDE NIHON NOHYAKU CO LTD 2014-09-03 CN disclosed
WO-2013065725-A1 PHTHALAMIDE DERIVATIVE, PESTICIDE FOR AGRICULTURAL AND HORTICULTURAL APPLICATIONS WHICH COMPRISES SAID DERIVATIVE, AND METHOD OF UTILIZING SAID PESTICIDE 日本農薬株式会社 (JP) 2013-05-10 WO disclosed