SCHEMBL14934059

SCHEMBL14934059

CNc1cc(C(F)(C(F)(F)F)C(F)(F)F)ccc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ KIF11 P52732 4/20 0.35
▸ ALDH1A1 P00352 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ GFER P55789 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ CFTR P13569 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ PRKCI P41743 1/20 0.33
▸ PTGS1 P23219 1/20 0.32

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
SCHEMBL14934058 0.85 MEN1 (0.45) MEN1KMT2AALOX15TSHRMAPK1
SCHEMBL118960 0.85 ALDH1A1 (0.46) MEN1KMT2AALOX15TSHRMAPK1
SCHEMBL30167000 0.85 ALDH1A1 (0.46) MEN1KMT2AALOX15TSHRMAPK1
SCHEMBL23455648 0.79 ALDH1A1 (0.48) MEN1KMT2AALOX15TSHRMAPK1
SCHEMBL28991341 0.77 MEN1 (0.41) MEN1KMT2AALOX15TSHRMAPK1
SCHEMBL2106514 0.77 MAPK1 (0.47) MEN1KMT2AALOX15TSHRMAPK1
SCHEMBL2718835 0.76 CYP3A4 (0.48) ALOX15TSHRMAPK1ALDH1A1MAPT
SCHEMBL29598324 0.76 CYP3A4 (0.48) ALOX15TSHRMAPK1ALDH1A1MAPT
SCHEMBL5958675 0.76 ALDH1A1 (0.41) MEN1KMT2AALOX15TSHRMAPK1
SCHEMBL25533196 0.74 MEN1 (0.36) MEN1KMT2AALOX15TSHRMAPK1

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
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
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