SCHEMBL10241398

SCHEMBL10241398

Fc1cccc(Cl)c1-c1nc(NCCN2CCOCC2)nc(N/N=C/c2ccc(OC(F)(F)F)cc2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 4/20 0.41
BCR P11274 4/20 0.41
LMNA P02545 2/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TRPV1 Q8NER1 1/20 0.38
EPHX2 P34913 1/20 0.37
PIK3CA P42336 2/20 0.37
MTOR P42345 2/20 0.37
GAA P10253 1/20 0.37
MAPK1 P28482 1/20 0.37
BACE1 P56817 1/20 0.37
MET P08581 1/20 0.37
PIM1 P11309 1/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL414896 1.00 ABL1 (0.41) ABL1BCRLMNAMEN1KMT2A
SCHEMBL414897 1.00 ABL1 (0.41) ABL1BCRLMNAMEN1KMT2A
SCHEMBL432860 0.94 ABL1 (0.39) ABL1BCRLMNAMEN1KMT2A
SCHEMBL432859 0.94 ABL1 (0.39) ABL1BCRLMNAMEN1KMT2A
SCHEMBL10204790 0.88 LMNA (0.42) LMNAMEN1KMT2APIK3CAMTOR
SCHEMBL10240649 0.85 MEN1 (0.40) LMNAMEN1KMT2ATRPV1GAA
SCHEMBL416309 0.85 MEN1 (0.40) LMNAMEN1KMT2ATRPV1GAA
SCHEMBL414779 0.85 MEN1 (0.40) LMNAMEN1KMT2ATRPV1GAA
SCHEMBL8909899 0.82 ABL1 (0.56) ABL1BCRLMNAMEN1KMT2A
SCHEMBL10241405 0.82 EGFR (0.35) ABL1BCRLMNAMEN1KMT2A

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