SCHEMBL20076459

SCHEMBL20076459

C=C(C)c1cc(NC(=C)C2C(c3cc(C)cc(C)c3)C2(Cl)Cl)ccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.37
MEN1 O00255 5/20 0.37
ALDH1A1 P00352 2/20 0.37
RECQL P46063 1/20 0.37
LMNA P02545 4/20 0.36
MAPT P10636 3/20 0.36
GAA P10253 1/20 0.36
CSF1R P07333 4/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 2/20 0.32
HPGD P15428 1/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL21021736 0.94 KMT2A (0.38) KMT2AMEN1ALDH1A1RECQLLMNA
SCHEMBL20076742 0.84 MEN1 (0.31) KMT2AMEN1ALDH1A1RECQLLMNA
SCHEMBL21021607 0.83 MEN1 (0.37) KMT2AMEN1ALDH1A1RECQLLMNA
SCHEMBL21019976 0.82 HTT (0.37) KMT2AMEN1ALDH1A1RECQLLMNA
SCHEMBL20076812 0.82 KMT2A (0.41) KMT2AMEN1ALDH1A1RECQLLMNA
SCHEMBL21021195 0.80 MEN1 (0.39) KMT2AMEN1ALDH1A1RECQLLMNA
SCHEMBL21020711 0.80 MEN1 (0.36) KMT2AMEN1ALDH1A1RECQLLMNA
SCHEMBL21021331 0.79 MEN1 (0.37) KMT2AMEN1ALDH1A1RECQLLMNA
SCHEMBL21021535 0.78 MEN1 (0.37) KMT2AMEN1ALDH1A1RECQLLMNA
SCHEMBL20076465 0.77 NPC1 (0.31) KMT2AMEN1ALDH1A1RECQLGAA

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
WO-2018071327-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2018-04-19 WO disclosed