SCHEMBL20076548

SCHEMBL20076548

C=C(Nc1ccc(C)c(C)c1)C1C(c2cc(C)cc(Cl)c2)C1(C)Cl

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.34
ALDH1A1 P00352 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RAB9A P51151 5/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
MAPT P10636 3/20 0.33
GAA P10253 2/20 0.33
NPC1 O15118 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
IDH1 O75874 1/20 0.33
RECQL P46063 1/20 0.33
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.31
F13A1 P00488 1/20 0.31
TGM2 P21980 1/20 0.31
SLC9A1 P19634 1/20 0.31
KCNH2 Q12809 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
SCHEMBL21021594 0.93 POLB (0.37) POLBALDH1A1L3MBTL1RAB9AMEN1
SCHEMBL21020695 0.88
SCHEMBL20076742 0.84 MEN1 (0.31) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL21022178 0.84 HTT (0.31) ALDH1A1RAB9AMEN1KMT2ANPC1
SCHEMBL21021086 0.84 SLC1A3 (0.32)
SCHEMBL20076667 0.84 GSTO1 (0.31) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL20076568 0.83
SCHEMBL21020662 0.83 MEN1 (0.31) ALDH1A1RAB9AMEN1KMT2AMAPT
SCHEMBL21021465 0.83 MEN1 (0.34) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL20076442 0.82 MEN1 (0.38) ALDH1A1L3MBTL1RAB9AMEN1KMT2A

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-2018071327-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2018-04-19 WO disclosed