SCHEMBL5884145

SCHEMBL5884145

Fc1ccc(Oc2ccc(-c3nc4ccccc4n3CCC3CCCCN3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 2/20 0.55
LTA4H P09960 6/20 0.49
PDE6D O43924 1/20 0.46
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
DRD2 P14416 2/20 0.45
DRD3 P35462 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
PIN1 Q13526 2/20 0.44
SCN9A Q15858 1/20 0.43
HSD17B10 Q99714 1/20 0.42
MCHR1 Q99705 2/20 0.42

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
SCHEMBL5883733 0.93 NPY1R (0.58) NPY1RLTA4HPDE6DKDM4EALDH1A1
SCHEMBL5883817 0.84 NPY1R (0.53) NPY1RLTA4HKDM4EPIN1MCHR1
SCHEMBL5883736 0.81 NPY1R (0.50) NPY1RLTA4HKDM4EALDH1A1LMNA
SCHEMBL5883769 0.80 NPY1R (0.55) NPY1RLTA4HPDE6DDRD2DRD3
SCHEMBL5884155 0.79 SCN9A (0.60) LTA4HKDM4EALDH1A1LMNAGAA
SCHEMBL5883568 0.79 NPY1R (0.48) NPY1RLTA4HLMNADRD2DRD3
SCHEMBL5884152 0.76 PDE6D (0.47) LTA4HPDE6DKDM4EALDH1A1LMNA
SCHEMBL5884179 0.76 NPY1R (0.57) NPY1RPDE6DKDM4EALDH1A1GAA
SCHEMBL29056704 0.75 TP53 (0.58) NPY1RPDE6DKDM4ELMNATSHR
SCHEMBL5883938 0.75 PTGER4 (0.59)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7022714-B2 Aryl substituted benzimidazoles and their use as sodium channel blockers EURO-CELTIQUE S.A. (LU) 2006-04-04 US claimed
EP-1532119-A2 ARYL SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS SODIUM CHANNEL BLOCKERS Euro-Celtique S.A. (LU) 2005-05-25 EP claimed
US-20040132777-A1 Aryl substituted benzimidazoles and their use as sodium channel blockers PURDUE PHARMA L.P. 2004-07-08 US claimed
WO-2004011439-A2 ARYL SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS SODIUM CHANNEL BLOCKERS EURO-CELTIQUE S.A. (LU) 2004-02-05 WO claimed
US-7022714-B2 Aryl substituted benzimidazoles and their use as sodium channel blockers EURO-CELTIQUE S.A. (LU) 2006-04-04 US disclosed
EP-1532119-A2 ARYL SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS SODIUM CHANNEL BLOCKERS Euro-Celtique S.A. (LU) 2005-05-25 EP disclosed
US-20040132777-A1 Aryl substituted benzimidazoles and their use as sodium channel blockers PURDUE PHARMA L.P. 2004-07-08 US disclosed
WO-2004011439-A2 ARYL SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS SODIUM CHANNEL BLOCKERS EURO-CELTIQUE S.A. (LU) 2004-02-05 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-20040132777-A1 Aryl substituted benzimidazoles and their use as sodium channel blockers CACNA1S, CACNA1I, SCN1A NPY1R 2315/4885LTA4H 1069/4885PDE6D 3882/4885

“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.