SCHEMBL6166994

SCHEMBL6166994

CCCCOC(=O)N1CCC(c2nc(-c3ccc(-c4ccccc4)cc3)c[nH]2)CC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
P2RY12 Q9H244 18/20 0.45
PRMT5 O14744 1/20 0.43

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
SCHEMBL6165607 0.91 HRH2 (0.45) KDM4EALDH1A1HPGDHSD17B10P2RY12
SCHEMBL6167825 0.91 ALDH1A1 (0.54) KDM4EALDH1A1HPGDHSD17B10P2RY12
SCHEMBL6164853 0.90 HTT (0.46) KDM4EALDH1A1HPGDHSD17B10P2RY12
SCHEMBL6167984 0.90 P2RY12 (0.44) P2RY12
SCHEMBL6168057 0.89 MEN1 (0.41) KDM4EALDH1A1HPGDP2RY12
SCHEMBL6167911 0.87 L3MBTL1 (0.37) KDM4EALDH1A1HPGDHSD17B10P2RY12
SCHEMBL2834139 0.85 ALDH1A1 (0.51) KDM4EALDH1A1HPGDHSD17B10P2RY12
SCHEMBL6164723 0.85 HTR2B (0.43) ALDH1A1HPGDP2RY12
SCHEMBL6167382 0.82 MEN1 (0.46) P2RY12
SCHEMBL6169344 0.82 DAGLA (0.41) ALDH1A1P2RY12

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 KDM4E 1438/4885ALDH1A1 1443/4885HPGD 1922/4885

“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.