SCHEMBL21021630

SCHEMBL21021630

C=Cc1cccc(NC(=C)C2C(c3cc(C)cc(C)c3)C2(C)Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
ALDH1A1 P00352 1/20 0.37
RECQL P46063 1/20 0.37
TP53 P04637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
EGFR P00533 2/20 0.33
MMP1 P03956 2/20 0.33
MMP2 P08253 2/20 0.33
MMP9 P14780 2/20 0.33
MAOB P27338 2/20 0.33
POLB P06746 1/20 0.33
MAOA P21397 1/20 0.33
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
CCKBR P32239 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
SCHEMBL21021121 0.87 MEN1 (0.48) MEN1KMT2AALDH1A1RECQLEGFR
SCHEMBL21021594 0.80 POLB (0.37) MEN1KMT2AALDH1A1RECQLTP53
SCHEMBL21021520 0.75
SCHEMBL21021200 0.73 CNR1 (0.38) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL20077008 0.72
SCHEMBL21020672 0.72 MEN1 (0.33) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL20076740 0.71 MEN1 (0.38) MEN1KMT2AALDH1A1TP53TDP1
SCHEMBL21021326 0.71 MEN1 (0.37) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021465 0.71 MEN1 (0.34) MEN1KMT2AALDH1A1RECQLTP53
SCHEMBL21021607 0.70 MEN1 (0.37) MEN1KMT2AALDH1A1RECQLTP53

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