SCHEMBL21586751

SCHEMBL21586751

O=C(O)c1cc(NC(=O)C2[C@H](c3cc(Cl)c(Cl)c(Cl)c3)C2(Cl)Cl)ccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.49
KMT2A Q03164 7/20 0.49
ALDH1A1 P00352 3/20 0.49
RECQL P46063 1/20 0.49
LMNA P02545 3/20 0.49
KDM4E B2RXH2 2/20 0.49
POLB P06746 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
MAPT P10636 3/20 0.48
MAPK1 P28482 1/20 0.48
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.42
HTT P42858 4/20 0.40
HPGD P15428 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL19651304 1.00 MEN1 (0.49) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL18145955 1.00 MEN1 (0.49) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL18144039 0.90 MEN1 (0.52) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL18144037 0.90 MEN1 (0.52) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL18143756 0.90 MEN1 (0.52) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL19651302 0.90 MEN1 (0.52) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL30739942 0.90 MEN1 (0.49) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21586912 0.90 MEN1 (0.49) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL18146058 0.90 MEN1 (0.49) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL19651213 0.90 MEN1 (0.49) 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