SCHEMBL4298779

SCHEMBL4298779

Clc1cc(-c2ccc(Cl)c(Cl)c2)nc(C2CC2)n1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMO O15229 6/20 0.41
AHR P35869 2/20 0.41
ABL1 P00519 1/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SLC6A3 Q01959 1/20 0.37
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
PSD A5PKW4 2/20 0.36
CYP1B1 Q16678 1/20 0.36
AR P10275 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL3404330 0.84 ABL1 (0.44) KMOAHRABL1NPC1RAB9A
SCHEMBL602965 0.80 KDM4E (0.54) LMNAHPGDKDM4ESMN1; SMN2
SCHEMBL1286211 0.74 PDE10A (0.50)
SCHEMBL21368660 0.73 KDM4E (0.50) NPC1RAB9ALMNAHPGDKDM4E
SCHEMBL19894137 0.71 PDE10A (0.43) NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL13663327 0.71 FAAH (0.51)
SCHEMBL3403338 0.71 FAAH (0.51)
SCHEMBL4906062 0.68 KMT2A (0.39) KMOHPGD
SCHEMBL4904088 0.66 MAPK14 (0.38) KMONPC1RAB9ASLC6A3SMN1; SMN2
SCHEMBL26647247 0.66 PDE10A (0.44)

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
US-8598202-B2 Aryl-hydroxyethylamino-pyrimidines and triazines as modulators of fatty acid amide hydrolase JANSSEN PHARMACEUTICA NV (BE) 2013-12-03 US disclosed
EP-2254415-B1 ARYL-HYDROXYETHYLAMINO-PYRIMIDINES AND TRIAZINES AS MODULATORS OF FATTY ACID AMIDE HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2013-01-23 EP disclosed
US-20090264429-A1 Aryl - Hydroxyethylamino - Pyrimidines and Triazines as Modulators of Fatty Acid amide Hydrolase JANSSEN PHARMACEUTICA NV (BE) 2009-10-22 US 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 (1 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-20090264429-A1 Aryl - Hydroxyethylamino - Pyrimidines and Triazines as Modulators of Fatty Acid amide Hydrolase FAAH, FAAH2, HRH2 KMO 139/4885AHR 12/4885ABL1 3297/4885

“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.