SCHEMBL21022022

SCHEMBL21022022

C=C(Nc1ccc(N)c(F)c1)c1cc(NC(=C)C2C(c3cc(C)cc(Cl)c3)C2(Cl)Cl)ccc1Cl

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
RECQL P46063 1/20 0.32
FADS1 O60427 1/20 0.30
LMNA P02545 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
SCHEMBL21022201 0.86 MEN1 (0.37) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021274 0.86 HTT (0.36) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021581 0.84 FADS1 (0.31) MEN1KMT2AALDH1A1FADS1LMNA
SCHEMBL21021736 0.83 KMT2A (0.38) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021313 0.83 MEN1 (0.30) MEN1KMT2AALDH1A1LMNA
SCHEMBL21021436 0.82 HTT (0.37) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021606 0.80 ALDH1A1 (0.31) MEN1KMT2AALDH1A1RECQL
SCHEMBL21022107 0.79 MEN1 (0.35) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL20076431 0.79 MEN1 (0.37) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21020721 0.78 SLC9A1 (0.36) MEN1KMT2AALDH1A1LMNA

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