SCHEMBL3640628

SCHEMBL3640628

O=C(Nc1noc2ccccc12)N1CCNCC1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.59
EPHX2 P34913 1/20 0.57
POLB P06746 1/20 0.52
TP53 P04637 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
MAPT P10636 1/20 0.46

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
Trifluoroacetic Acid SCHEMBL3766157 0.92 FAAH (0.55) FAAHEPHX2POLBTP53SMN1; SMN2
SCHEMBL3766399 0.85 FAAH (0.67) FAAHEPHX2TP53SMN1; SMN2MAPT
SCHEMBL3761183 0.82 FAAH (0.66) FAAHEPHX2TP53SMN1; SMN2MAPT
SCHEMBL3765495 0.82 FAAH (0.69) FAAHEPHX2
Hydrochloric Acid SCHEMBL3770663 0.81 FAAH (0.68) FAAHEPHX2
SCHEMBL3765745 0.80 FAAH (0.61) FAAHEPHX2POLBTP53
SCHEMBL3764625 0.78 FAAH (0.56) FAAHEPHX2POLBTP53MAPT
SCHEMBL3641179 0.78 FAAH (0.56) FAAHEPHX2TP53SMN1; SMN2MAPT
SCHEMBL3770680 0.78 FAAH (0.56) FAAHEPHX2TP53SMN1; SMN2MAPT
SCHEMBL3768198 0.78 FAAH (0.59) FAAHEPHX2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2164493-A2 HETEROARYL-SUBSTITUTED UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE Janssen Pharmaceutica, N.V. (BE) 2010-03-24 EP disclosed
US-20090062294-A1 HETEROARYL-SUBSTITUTED UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2009-03-05 US disclosed
WO-2008153752-A2 HETEROARYL-SUBSTITUTED UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE JANSSEN PHARMACEUTICA N.V. (BE) 2008-12-18 WO disclosed
EP-1813606-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2007-08-01 EP 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-20090062294-A1 HETEROARYL-SUBSTITUTED UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, GPR119 FAAH 1/4885EPHX2 424/4885POLB 1725/4885

“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.