SCHEMBL21021607

SCHEMBL21021607

C=Cc1cc(NC(=C)C2C(c3cc(C)cc(C)c3)C2(Cl)Cl)ccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
ALDH1A1 P00352 2/20 0.37
RECQL P46063 1/20 0.37
MAPT P10636 4/20 0.35
LMNA P02545 3/20 0.35
GAA P10253 1/20 0.35
GSTO1 P78417 1/20 0.33
HTT P42858 2/20 0.32
MAPK1 P28482 1/20 0.32
HPGD P15428 1/20 0.32
TP53 P04637 1/20 0.31
THRB P10828 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL21021535 0.95 MEN1 (0.37) MEN1KMT2AALDH1A1RECQLMAPT
SCHEMBL21021326 0.90 MEN1 (0.37) MEN1KMT2AALDH1A1RECQLMAPT
SCHEMBL21021871 0.86 MEN1 (0.37) MEN1KMT2AALDH1A1RECQLMAPT
SCHEMBL21022206 0.85 MEN1 (0.36) MEN1KMT2AALDH1A1RECQLMAPT
SCHEMBL20076667 0.85 GSTO1 (0.31) MEN1KMT2AALDH1A1RECQLMAPT
SCHEMBL21021520 0.83
SCHEMBL20076459 0.83 KMT2A (0.37) MEN1KMT2AALDH1A1RECQLMAPT
SCHEMBL20076812 0.81 KMT2A (0.41) MEN1KMT2AALDH1A1RECQLMAPT
SCHEMBL21020679 0.80 MEN1 (0.31) MEN1KMT2AALDH1A1RECQL
SCHEMBL20076458 0.80 MEN1 (0.30) MEN1KMT2AALDH1A1RECQL

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