SCHEMBL10697710

SCHEMBL10697710

N[C@@H](Cc1c(Cl)cc(S(=O)(=O)C(F)(F)F)cc1Cl)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRB2 P62993 1/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ CASR P41180 2/20 0.38
▸ USP2 O75604 3/20 0.36
▸ PKM P14618 2/20 0.36
▸ ALOX15 P16050 2/20 0.36
▸ HIF1A Q16665 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ RECQL P46063 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ RGS12 O14924 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ BRCA1 P38398 1/20 0.36
▸ THPO P40225 1/20 0.36
▸ CASP7 P55210 1/20 0.36

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
SCHEMBL7818683 0.79 GRB2 (0.45) GRB2MEN1KMT2AUSP2PKM
SCHEMBL7818681 0.79 GRB2 (0.45) GRB2MEN1KMT2AUSP2PKM
SCHEMBL5327701 0.75 SLC7A5 (0.50) MEN1KMT2AUSP2PKMALOX15
SCHEMBL5327704 0.75 SLC7A5 (0.50) MEN1KMT2AUSP2PKMALOX15
SCHEMBL2265488 0.75 USP2 (0.44) MEN1KMT2AUSP2PKMALOX15
SCHEMBL29398675 0.70 SLC7A5 (0.55) MEN1KMT2APKMALOX15HSD17B10
SCHEMBL29397997 0.70 SLC7A5 (0.55) MEN1KMT2APKMALOX15HSD17B10
SCHEMBL28839577 0.70 SLC7A5 (0.55) MEN1KMT2APKMALOX15HSD17B10
SCHEMBL11062896 0.69 CA2 (0.57) MEN1KMT2ATDP1CYP3A4CYP2C9
SCHEMBL10499080 0.69 ALDH1A1 (0.44) MEN1KMT2ACYP2C9ALDH1A1LMNA

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
EP-0272533-A2 Substituted phenoxypyridines BAYER AG (DE) 1988-06-29 — — EP disclosed
Send feedback