SCHEMBL21021098

SCHEMBL21021098

Cc1cc(NC(=O)C2C(c3ccc(Cl)c(Cl)c3)C2(Cl)Cl)ccc1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.52
KMT2A Q03164 7/20 0.52
LMNA P02545 4/20 0.52
ALDH1A1 P00352 1/20 0.52
RECQL P46063 1/20 0.52
MAPT P10636 2/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 5/20 0.46
HPGD P15428 1/20 0.46
SLC2A1 P11166 1/20 0.44
SLC9A1 P19634 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL21022044 0.91 MEN1 (0.52) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL21021817 0.91 MEN1 (0.53) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL21021818 0.91 MEN1 (0.53) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL21021732 0.90 MEN1 (0.53) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL21021955 0.87 MEN1 (0.50) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL21021865 0.87 MEN1 (0.55) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL21015373 0.85 MEN1 (0.54) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL20045639 0.85 MEN1 (0.54) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL20076747 0.83 MEN1 (0.48) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL18147045 0.83 MEN1 (0.47) MEN1KMT2ALMNAALDH1A1RECQL

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