SCHEMBL21022178

SCHEMBL21022178

C=C(Nc1ccc(C)c(-c2ccc(C)cc2F)c1)C1C(c2cc(C)cc(Cl)c2)C1(C)Cl

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
IDH1 O75874 1/20 0.30
ALDH1A1 P00352 1/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL21020238 0.91
SCHEMBL20076805 0.85 SLC1A3 (0.30)
SCHEMBL21021086 0.85 SLC1A3 (0.32)
SCHEMBL20076548 0.84 POLB (0.34) HTTMEN1KMT2ANPC1RAB9A
SCHEMBL21021114 0.82
SCHEMBL21020555 0.81 HTT (0.34) HTTMEN1KMT2ANPC1LMNA
SCHEMBL21020723 0.81 MEN1 (0.34) HTTMEN1KMT2ALMNAALDH1A1
SCHEMBL21020662 0.81 MEN1 (0.31) HTTMEN1KMT2ANPC1LMNA
SCHEMBL21020695 0.79
SCHEMBL21021239 0.79 MEN1 (0.31) MEN1KMT2AALDH1A1RECQL

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