SCHEMBL28522802

SCHEMBL28522802

NC(=O)c1cc(C(F)(F)F)cc(S(=O)(=O)C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.46
MAPT P10636 3/20 0.43
GAA P10253 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
KIF11 P52732 1/20 0.40
ALDH1A1 P00352 1/20 0.40
DHODH Q02127 1/20 0.38
CA2 P00918 3/20 0.37
CA1 P00915 2/20 0.37
ATF1 P18846 1/20 0.37
NFKB1 P19838 1/20 0.37
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
PKM P14618 1/20 0.37
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 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
SCHEMBL31443004 1.00 CES2 (0.46) CES2MAPTGAANPSR1LMNA
SCHEMBL20565322 0.89 ALDH1A1 (0.44) CES2GAALMNAKMT2AKIF11
SCHEMBL9797089 0.86 CES2 (0.48) CES2MAPTGAANPSR1LMNA
SCHEMBL29482054 0.84 CES2 (0.47) CES2MAPTGAAKMT2AALDH1A1
SCHEMBL21609775 0.84 CES2 (0.47) CES2MAPTGAAKMT2AALDH1A1
SCHEMBL11296813 0.83 CES2 (0.46) CES2MAPTGAANPSR1LMNA
SCHEMBL30219246 0.83 CES2 (0.46) CES2MAPTGAANPSR1LMNA
SCHEMBL627995 0.81 CES2 (0.67) CES2MAPTGAANPSR1LMNA
Hydrochloric Acid SCHEMBL4372326 0.79 CES2 (0.64) CES2MAPTGAANPSR1LMNA
Hydrochloric Acid SCHEMBL4027010 0.79 CES2 (0.64) CES2MAPTGAANPSR1LMNA

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-112351978-A Pesticidally active azole-amide compounds 先正达参股股份有限公司 2021-02-09 CN disclosed