SCHEMBL21021817

SCHEMBL21021817

Cc1cc(NC(=O)C2C(c3ccc(Cl)c(Cl)c3)C2(Cl)Cl)ccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.53
KMT2A Q03164 6/20 0.53
ALDH1A1 P00352 1/20 0.53
RECQL P46063 1/20 0.53
LMNA P02545 3/20 0.49
MAPT P10636 2/20 0.49
MAPK1 P28482 1/20 0.49
HTT P42858 4/20 0.46
HPGD P15428 1/20 0.46
EPHX1 P07099 1/20 0.41
EPHX2 P34913 1/20 0.41
CYP3A4 P08684 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
NPC1 O15118 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GAA P10253 1/20 0.40
APEX1 P27695 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
SCHEMBL21021818 1.00 MEN1 (0.53) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021098 0.91 MEN1 (0.52) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21022044 0.91 MEN1 (0.52) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21022476 0.90 MEN1 (0.53) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21022387 0.90 MEN1 (0.53) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021955 0.89 MEN1 (0.50) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21587427 0.88 MEN1 (0.54) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021994 0.88 MEN1 (0.56) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021126 0.88 MEN1 (0.56) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL20076747 0.87 MEN1 (0.48) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3971166-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND COMPOSITIONS, AND PROCESSES, RELATED THERETO Corteva Agriscience LLC (US) 2022-03-23 EP disclosed
EP-3964495-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND COMPOSITIONS, AND PROCESSES, RELATED THERETO Dow AgroSciences LLC (US) 2022-03-09 EP disclosed
EP-3283459-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-22 EP disclosed