SCHEMBL20076419

SCHEMBL20076419

C=C(Nc1ccc(C)c(CCC)c1Cl)C1C(c2ccc(F)c(Cl)c2)C1(C)Cl

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SLC9A1 P19634 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
SCHEMBL20076442 0.78 MEN1 (0.38) MEN1KMT2ASLC9A1
SCHEMBL20076770 0.77 SLC9A1 (0.38) SLC9A1
SCHEMBL20076397 0.72 TSHR (0.34) MEN1KMT2A
SCHEMBL21021915 0.72 MEN1 (0.42) MEN1KMT2A
SCHEMBL20076567 0.71 SLC9A1 (0.36) MEN1KMT2ASLC9A1
SCHEMBL20076832 0.68 SLC9A1 (0.43) SLC9A1
SCHEMBL21022257 0.67 NPC1 (0.31) MEN1KMT2A
SCHEMBL20076701 0.67 SLC9A1 (0.42) MEN1KMT2ASLC9A1
SCHEMBL20076383 0.67 SLC9A1 (0.35) SLC9A1
SCHEMBL21021646 0.67 NPC1 (0.35) MEN1KMT2A

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