SCHEMBL416229

SCHEMBL416229

FC(F)(F)Oc1ccc(/C=N\Nc2nc(Nc3ccc(Cl)nc3)cc(-c3ccccc3)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.43
MET P08581 1/20 0.43
ROS1 P08922 1/20 0.43
ALK Q9UM73 1/20 0.43
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
LMNA P02545 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
ALDH1A1 P00352 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MAPT P10636 6/20 0.41
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
MAPK1 P28482 2/20 0.41
GAA P10253 2/20 0.41
MITF O75030 1/20 0.41
CTSC P53634 1/20 0.40
HTT P42858 2/20 0.39
ABL1 P00519 5/20 0.39
BCR P11274 5/20 0.39

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
SCHEMBL416230 1.00 EGFR (0.43) EGFRMETROS1ALKNPC1
SCHEMBL10242548 1.00 EGFR (0.43) EGFRMETROS1ALKNPC1
SCHEMBL415579 0.89 MAPT (0.50) EGFRMETROS1ALKNPC1
SCHEMBL10240830 0.89 MAPT (0.50) EGFRMETROS1ALKNPC1
SCHEMBL418073 0.89 MAPT (0.50) EGFRMETROS1ALKNPC1
SCHEMBL415556 0.86 EGFR (0.41) EGFRMETROS1ALKNPC1
SCHEMBL17836759 0.86 EGFR (0.41) EGFRMETROS1ALKNPC1
SCHEMBL415557 0.86 EGFR (0.41) EGFRMETROS1ALKNPC1
SCHEMBL413715 0.86 GPR39 (0.48) EGFRMETROS1ALKNPC1
SCHEMBL10240829 0.86 GPR39 (0.48) EGFRMETROS1ALKNPC1

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 9 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
US-9321735-B2 Insecticidal triazines and pyrimidines Vestaron Corporation (US) 2016-04-26 US disclosed
US-8785630-B2 Insecticidal triazines and pyrimidines Vestaron Corporation (US) 2014-07-22 US disclosed
US-20130267705-A1 Insecticidal Triazines and Pyrimidines Vestaron Corporation (US) 2013-10-10 US disclosed
US-20130150365-A1 Insecticidal Triazines and Pyrimidines Vestaron Corporation (US) 2013-06-13 US disclosed
EP-2595965-A1 INSECTICIDAL TRIAZINES AND PYRIMIDINES Vestaron Corporation (US) 2013-05-29 EP disclosed
US-8389718-B2 Insecticidal triazines and pyrimidines Vestaron Corporation (US) 2013-03-05 US disclosed
US-20120022066-A1 Insecticidal Triazines and Pyrimidines Vestaron Corporation (US) 2012-01-26 US disclosed
WO-2012012528-A1 INSECTICIDAL TRIAZINES AND PYRIMIDINES Vestaron Corporation (US) 2012-01-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130150365-A1 Insecticidal Triazines and Pyrimidines TYMS, TYMP, DHX15 EGFR 4624/4885MET 4728/4885ROS1 3076/4885
US-20120022066-A1 Insecticidal Triazines and Pyrimidines TYMS, TYMP, DHX15 EGFR 4624/4885MET 4728/4885ROS1 3076/4885
US-20130267705-A1 Insecticidal Triazines and Pyrimidines TYMS, TYMP, DHX15 EGFR 4624/4885MET 4728/4885ROS1 3076/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.