SCHEMBL21021207

SCHEMBL21021207

C=C(Nc1ccc(F)c(-c2ccc(C)cc2)c1)C1C(c2ccc(C)c(Cl)c2)C1(Cl)Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
LMNA P02545 4/20 0.37
HTT P42858 3/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 2/20 0.35
RECQL P46063 1/20 0.35
HPGD P15428 1/20 0.34
SLC1A3 P43003 1/20 0.34
SLC1A2 P43004 1/20 0.34
SLC1A1 P43005 1/20 0.34
THRB P10828 1/20 0.33
EPHB4 P54760 1/20 0.33
TEK Q02763 1/20 0.33
MAPT P10636 3/20 0.32
MAPK14 Q16539 1/20 0.32
BCL9 O00512 2/20 0.32
CTNNB1 P35222 2/20 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
SCHEMBL21020626 0.82 MAPK14 (0.37) MEN1KMT2ALMNAHTTALDH1A1
SCHEMBL21021225 0.81 HTT (0.38) MEN1KMT2ALMNAHTTALDH1A1
SCHEMBL21021614 0.81 MEN1 (0.32) MEN1KMT2ALMNAHTTNPC1
SCHEMBL21020562 0.80 KMT2A (0.49) MEN1KMT2ALMNAHTTALDH1A1
SCHEMBL21022118 0.78 KMT2A (0.50) MEN1KMT2ALMNAHTTNPC1
SCHEMBL21021322 0.77 MEN1 (0.38) MEN1KMT2ALMNAHTTNPC1
SCHEMBL21020536 0.77 MAPK14 (0.40) MEN1KMT2ALMNAHTTALDH1A1
SCHEMBL21020810 0.76 LMNA (0.36) MEN1KMT2ALMNAHTTNPC1
SCHEMBL21020814 0.74 MEN1 (0.36) MEN1KMT2ALMNAHTTNPC1
SCHEMBL20076571 0.74 HTT (0.39) MEN1KMT2ALMNAHTTALDH1A1

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-3283459-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-22 EP disclosed