SCHEMBL5864786

SCHEMBL5864786

Nc1ccc(OC2CCN(CCc3ccccc3)CC2)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 1/20 0.55
SCN8A Q9UQD0 1/20 0.55
SIGMAR1 Q99720 4/20 0.48
DRD2 P14416 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR2B P41595 1/20 0.48
ACHE P22303 1/20 0.47
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
HSD17B10 Q99714 1/20 0.47
LMNA P02545 1/20 0.46
CCR3 P51677 1/20 0.46
HTR1A P08908 1/20 0.46
SLC6A4 P31645 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
SCHEMBL5864862 0.89 SMN1; SMN2 (0.54) SCN1ASCN8ASIGMAR1GAA
SCHEMBL5864814 0.83 SCN8A (0.49) SCN1ASCN8AALDH1A1LMNA
SCHEMBL5864902 0.81 SCN1A (0.55) SCN1ASCN8ASIGMAR1HTR2AACHE
SCHEMBL5864791 0.81 HTR4 (0.47) SIGMAR1HTR2CHTR2BACHEMAOA
SCHEMBL5864782 0.80 HRH3 (0.48) SCN1ASCN8AALDH1A1GAA
SCHEMBL5864969 0.79 ALDH1A1 (0.43) HTR2CALDH1A1GAALMNASLC6A4
SCHEMBL3973906 0.78 KDM4E (0.49) HTR2CHTR2BALDH1A1
SCHEMBL19852051 0.78 CARM1 (0.64) SIGMAR1DRD2HTR2AHTR2CHTR2B
SCHEMBL5865015 0.77 SCN8A (0.59) SCN1ASCN8ASIGMAR1DRD2ACHE
SCHEMBL20694348 0.76 ALDH1A1 (0.50) ALDH1A1GAA

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-7030138-B2 Benzamidine derivatives SANKYO COMPANY, LIMITED (JP) 2006-04-18 US disclosed
US-20040147555-A1 Benzamidine derivatives SANKYO COMPANY, LIMITED (JP) 2004-07-29 US disclosed
EP-1375482-A1 BENZAMIDINE DERIVATIVE Sankyo Company, Limited (JP) 2004-01-02 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-20040147555-A1 Benzamidine derivatives F9, F7, F2 SCN1A 572/4885SCN8A 763/4885SIGMAR1 2222/4885

“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.