SCHEMBL1277145

SCHEMBL1277145

Clc1ccc(Oc2cccc(OCCC3CNC3)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.41
PPARG P37231 2/20 0.40
LTA4H P09960 2/20 0.40
ALDH1A1 P00352 1/20 0.40
PTGS2 P35354 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 2/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
MAOB P27338 2/20 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
Formic Acid SCHEMBL1277213 0.93 PPARG (0.41) SLC6A4PPARGALDH1A1KDM4ELMNA
SCHEMBL2299161 0.84 NFE2L2 (0.44) SLC6A4LTA4HPTGS2MAOB
SCHEMBL1277217 0.79 ALDH1A1 (0.39) PPARGLTA4HALDH1A1PTGS2KDM4E
SCHEMBL2792710 0.78 ALDH1A1 (0.44) PPARGALDH1A1KDM4ESMN1; SMN2PPARD
SCHEMBL2792293 0.74 TEAD1 (0.47) PPARGALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL16890736 0.73 ALDH1A1 (0.60) PPARGLTA4HALDH1A1KDM4ELMNA
SCHEMBL1277296 0.73 CSF1R (0.46) ALDH1A1
SCHEMBL20314095 0.73 LMNA (0.46) PPARGALDH1A1KDM4ELMNAMAPK1
SCHEMBL13064194 0.71 LTA4H (0.58) LTA4HALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL18745391 0.70 ACACB (0.47) LTA4HALDH1A1PTGS2KDM4ELMNA

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-8901111-B2 Aryl-substituted heterocyclic urea modulators of fatty acid amide hydrolase JANSSEN PHARMACEUTICA NV (BE) 2014-12-02 US disclosed
US-20120088741-A1 ARYL-SUBSTITUTED HETEROCYCLIC UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2012-04-12 US disclosed
WO-2010141809-A1 ARYL-SUBSTITUTED HETEROCYCLIC UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2010-12-09 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 (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-20120088741-A1 ARYL-SUBSTITUTED HETEROCYCLIC UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, APEH SLC6A4 1034/4885PPARG 112/4885LTA4H 76/4885

“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.