SCHEMBL413715

SCHEMBL413715

FC(F)(F)Oc1ccc(C=NNc2nc(NCc3ccc(Cl)nc3)cc(-c3ccccc3)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR39 O43194 3/20 0.48
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
EGFR P00533 1/20 0.40
MET P08581 1/20 0.40
ROS1 P08922 1/20 0.40
ALK Q9UM73 1/20 0.40
MAPT P10636 10/20 0.40
LMNA P02545 4/20 0.40
NPSR1 Q6W5P4 3/20 0.40
HTT P42858 3/20 0.40
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
BRD4 O60885 1/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
MAPK1 P28482 2/20 0.40
MITF O75030 1/20 0.37
GAA P10253 1/20 0.37
TDP1 Q9NUW8 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
SCHEMBL413714 1.00 GPR39 (0.48) GPR39NPC1RAB9AEGFRMET
SCHEMBL10240829 1.00 GPR39 (0.48) GPR39NPC1RAB9AEGFRMET
SCHEMBL416423 0.90 MAPT (0.51) GPR39NPC1RAB9AMAPTLMNA
SCHEMBL17836751 0.90 MAPT (0.51) GPR39NPC1RAB9AMAPTLMNA
SCHEMBL415522 0.90 MAPT (0.51) GPR39NPC1RAB9AMAPTLMNA
SCHEMBL10204851 0.86 MAPT (0.52) NPC1RAB9AMAPTLMNANPSR1
SCHEMBL416230 0.86 EGFR (0.43) NPC1RAB9AEGFRMETROS1
SCHEMBL416229 0.86 EGFR (0.43) NPC1RAB9AEGFRMETROS1
SCHEMBL10242548 0.86 EGFR (0.43) NPC1RAB9AEGFRMETROS1
SCHEMBL459932 0.80 MAPT (0.43) GPR39NPC1RAB9AMAPTLMNA

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2595965-B1 INSECTICIDAL TRIAZINES AND PYRIMIDINES VESTARON CORP (US) 2016-06-22 EP claimed
US-9321735-B2 Insecticidal triazines and pyrimidines Vestaron Corporation (US) 2016-04-26 US claimed
US-8785630-B2 Insecticidal triazines and pyrimidines Vestaron Corporation (US) 2014-07-22 US claimed
US-20130267705-A1 Insecticidal Triazines and Pyrimidines Vestaron Corporation (US) 2013-10-10 US claimed
US-20130150365-A1 Insecticidal Triazines and Pyrimidines Vestaron Corporation (US) 2013-06-13 US claimed
EP-2595965-A1 INSECTICIDAL TRIAZINES AND PYRIMIDINES Vestaron Corporation (US) 2013-05-29 EP claimed
CN-103052628-A Triazine and pyrimidine insecticides VESTARON CORP 2013-04-17 CN claimed
WO-2012012528-A1 INSECTICIDAL TRIAZINES AND PYRIMIDINES Vestaron Corporation (US) 2012-01-26 WO claimed
EP-2595965-B1 INSECTICIDAL TRIAZINES AND PYRIMIDINES VESTARON CORP (US) 2016-06-22 EP disclosed
CN-103052628-B Triazine and pyrimidine insecticides VESTARON CORP. (US) 2016-05-18 CN disclosed
US-9321735-B2 Insecticidal triazines and pyrimidines Vestaron Corporation (US) 2016-04-26 US 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-8785630-B2 Insecticidal triazines and pyrimidines Vestaron Corporation (US) 2014-07-22 US disclosed
CN-103052628-A Triazine and pyrimidine insecticides VESTARON CORP 2013-04-17 CN disclosed
US-8389718-B2 Insecticidal triazines and pyrimidines Vestaron Corporation (US) 2013-03-05 US 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
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 GPR39 3779/4885NPC1 4257/4885RAB9A 2500/4885
US-20120022066-A1 Insecticidal Triazines and Pyrimidines TYMS, TYMP, DHX15 GPR39 3779/4885NPC1 4257/4885RAB9A 2500/4885
US-20130267705-A1 Insecticidal Triazines and Pyrimidines TYMS, TYMP, DHX15 GPR39 3779/4885NPC1 4257/4885RAB9A 2500/4885

“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.