SCHEMBL6164853

SCHEMBL6164853

CCCCOC(=O)N1CCC(c2nc(-c3ccc(OC)cc3)c[nH]2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.46
CHRM2 P08172 1/20 0.45
CHRM1 P11229 1/20 0.45
SMYD3 Q9H7B4 1/20 0.45
MIF P14174 1/20 0.44
HRH2 P25021 1/20 0.44
HRH1 P35367 1/20 0.44
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 3/20 0.43
HTR2B P41595 1/20 0.43
MAPT P10636 3/20 0.42
MMP1 P03956 4/20 0.42
MMP2 P08253 4/20 0.42
MMP3 P08254 4/20 0.42
MMP7 P09237 4/20 0.42
MMP9 P14780 4/20 0.42
MMP8 P22894 4/20 0.42
MMP13 P45452 4/20 0.42
NPC1 O15118 1/20 0.41

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
SCHEMBL6166994 0.90 KDM4E (0.46) KDM4EALDH1A1HPGDHSD17B10P2RY12
SCHEMBL6165607 0.89 HRH2 (0.45) HTTHRH2HRH1KDM4EALDH1A1
SCHEMBL6168057 0.89 MEN1 (0.41) HTTHRH2HRH1KDM4EALDH1A1
SCHEMBL6166813 0.87 MIF (0.41) HTTSMYD3MIFHRH2HRH1
SCHEMBL6168935 0.83 HTR2B (0.48) HTTKDM4EALDH1A1HPGDHTR2B
SCHEMBL6167825 0.81 ALDH1A1 (0.54) HTTKDM4EALDH1A1HPGDHTR2B
SCHEMBL6167984 0.80 P2RY12 (0.44) P2RY12
SCHEMBL6166202 0.80 LMNA (0.40) HTTKDM4EALDH1A1HPGDMAPT
SCHEMBL2834139 0.77 ALDH1A1 (0.51) KDM4EALDH1A1HPGDHTR2BMAPT
SCHEMBL6167911 0.77 L3MBTL1 (0.37) CHRM2CHRM1KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1349850-B1 SODIUM CHANNEL MODULATORS DERIVED FROM 2-PIPERIDYLIMIDAZOLES SOD CONSEILS RECH APPLIC (FR) 2005-09-07 EP claimed
US-20040077640-A1 Sodium channel modulators derived from 2-piperidylimidazoles SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2004-04-22 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-20040077640-A1 Sodium channel modulators derived from 2-piperidylimidazoles KCNH1, HCN4, KCNH2 HTT 4159/4885CHRM2 1671/4885CHRM1 1441/4885

“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.