SCHEMBL432859

SCHEMBL432859

CN(C)Nc1nc(N/N=C\c2ccc(OC(F)(F)F)cc2)nc(-c2c(F)cccc2Cl)n1.Fc1cccc(Cl)c1-c1nc(NCCN2CCOCC2)nc(N/N=C\c2ccc(OC(F)(F)F)cc2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.39
BCR P11274 3/20 0.39
LMNA P02545 2/20 0.36
MET P08581 3/20 0.35
EGFR P00533 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
RAB9A P51151 1/20 0.34
EPHX2 P34913 1/20 0.34
PIK3CA P42336 1/20 0.34
MTOR P42345 1/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
PIM1 P11309 1/20 0.34
MAPK8 P45983 1/20 0.34
ROS1 P08922 1/20 0.34

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
SCHEMBL432860 1.00 ABL1 (0.39) ABL1BCRLMNAMETEGFR
SCHEMBL414897 0.94 ABL1 (0.41) ABL1BCRLMNAMETEGFR
SCHEMBL414896 0.94 ABL1 (0.41) ABL1BCRLMNAMETEGFR
SCHEMBL10241398 0.94 ABL1 (0.41) ABL1BCRLMNAMETEGFR
SCHEMBL10241402 0.86 EGFR (0.41) LMNAMETEGFRL3MBTL1MEN1
SCHEMBL417506 0.86 EGFR (0.41) LMNAMETEGFRL3MBTL1MEN1
SCHEMBL415934 0.86 EGFR (0.41) LMNAMETEGFRL3MBTL1MEN1
SCHEMBL10204790 0.85 LMNA (0.42) LMNAEGFRL3MBTL1MEN1KMT2A
SCHEMBL10240649 0.81 MEN1 (0.40) LMNAMETEGFRL3MBTL1TRPV1
SCHEMBL416309 0.81 MEN1 (0.40) LMNAMETEGFRL3MBTL1TRPV1

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-2595965-B1 INSECTICIDAL TRIAZINES AND PYRIMIDINES VESTARON CORP (US) 2016-06-22 EP disclosed
EP-2595965-A1 INSECTICIDAL TRIAZINES AND PYRIMIDINES Vestaron Corporation (US) 2013-05-29 EP disclosed
WO-2012012528-A1 INSECTICIDAL TRIAZINES AND PYRIMIDINES Vestaron Corporation (US) 2012-01-26 WO disclosed