SCHEMBL6168057

SCHEMBL6168057

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

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TRPC3 Q13507 1/20 0.41
TRPC7 Q9HCX4 1/20 0.41
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
P2RY12 Q9H244 8/20 0.39
HTT P42858 1/20 0.38
TRPC6 Q9Y210 1/20 0.38
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GRIN2B Q13224 1/20 0.38
MMP13 P45452 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 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
SCHEMBL6166994 0.89 KDM4E (0.46) P2RY12HPGDKDM4EALDH1A1
SCHEMBL6164853 0.89 HTT (0.46) MEN1KMT2AHRH2HRH1P2RY12
SCHEMBL6165607 0.88 HRH2 (0.45) TRPC3TRPC7HRH2HRH1P2RY12
SCHEMBL6167913 0.87 TRPC6 (0.34) MEN1KMT2ATRPC3TRPC7HRH2
SCHEMBL6166669 0.82 ABL1 (0.41) MEN1KMT2AHTTTRPC6HPGD
SCHEMBL6167825 0.79 ALDH1A1 (0.54) MEN1KMT2ATRPC3TRPC7P2RY12
SCHEMBL6166202 0.79 LMNA (0.40) MEN1KMT2ATRPC3TRPC7P2RY12
SCHEMBL6167984 0.79 P2RY12 (0.44) P2RY12
SCHEMBL27797117 0.77 P2RY14 (0.53) MEN1KMT2ATRPC3TRPC7HTT
Butyl Formate SCHEMBL27489056 0.76 P2RY14 (0.37) MEN1KMT2A

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 MEN1 4835/4885KMT2A 3010/4885TRPC3 85/4885

“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.