SCHEMBL21586912

SCHEMBL21586912

O=C(O)c1cc(NC(=O)C2[C@H](c3ccc(Cl)c(Cl)c3)C2(Cl)Cl)ccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.49
KMT2A Q03164 8/20 0.49
ALDH1A1 P00352 3/20 0.49
RECQL P46063 1/20 0.49
LMNA P02545 3/20 0.49
KDM4E B2RXH2 3/20 0.49
POLB P06746 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
MAPT P10636 4/20 0.48
MAPK1 P28482 1/20 0.48
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
NPSR1 Q6W5P4 1/20 0.42
NFKB1 P19838 1/20 0.41
GFER P55789 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTT P42858 2/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL30739942 1.00 MEN1 (0.49) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL18146058 1.00 MEN1 (0.49) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL19651213 1.00 MEN1 (0.49) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL18147006 0.91 MEN1 (0.54) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL18146335 0.91 MEN1 (0.54) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL30370187 0.91 MEN1 (0.54) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL19651309 0.91 MEN1 (0.54) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21015373 0.91 MEN1 (0.54) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL18147008 0.91 MEN1 (0.54) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL20045639 0.91 MEN1 (0.54) MEN1KMT2AALDH1A1RECQLLMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3964495-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND COMPOSITIONS, AND PROCESSES, RELATED THERETO Dow AgroSciences LLC (US) 2022-03-09 EP disclosed
EP-3578543-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO Dow AgroSciences LLC (US) 2019-12-11 EP disclosed