SCHEMBL4282387

SCHEMBL4282387

CN(C)c1ccc(CN2CCC(N(C3CC3)S(=O)(=O)c3ccccc3)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 2/20 0.51
CXCR4 P61073 2/20 0.49
HTR2A P28223 2/20 0.49
CACNA1B Q00975 1/20 0.46
HTR2C P28335 1/20 0.46
CHRM2 P08172 5/20 0.46
CHRM3 P20309 5/20 0.46
OPRM1 P35372 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
DRD2 P14416 1/20 0.45
KCNH2 Q12809 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
SCHEMBL14997384 0.89 HTR2A (0.61) CXCR4HTR2ACACNA1BCHRM2CHRM3
SCHEMBL4285276 0.86 CHRM4 (0.56) CXCR4HTR2ACACNA1BHTR2CKCNH2
SCHEMBL4281379 0.85 CACNA1B (0.67) CACNA1B
SCHEMBL4284277 0.85 HTR2A (0.48) ALDH1A1CXCR4HTR2ACACNA1BHTR2C
SCHEMBL4285152 0.85 SIGMAR1 (0.56) ALDH1A1KDM4ECXCR4HTR2ACACNA1B
SCHEMBL4286138 0.85 MEN1 (0.50) CXCR4HTR2ACACNA1BHTR2CSIGMAR1
SCHEMBL4285261 0.82 CACNA1B (0.46) ALDH1A1KDM4EHTR2ACACNA1BHTR2C
SCHEMBL4277843 0.81 ACHE (0.55) ALDH1A1KDM4EHTR2ACACNA1BSIGMAR1
SCHEMBL4277944 0.81 NPC1 (0.60) ALDH1A1KDM4E
SCHEMBL13541677 0.80 CACNA1B (0.53) ALDH1A1HTR2ACACNA1BHTR2COPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9000174-B2 4-phenylsulfonamidopiperidines as calcium channel blockers PURDUE PHARMA L.P. (US) 2015-04-07 US disclosed
EP-1814851-B1 4-PHENYLSULFONAMIDOPIPERIDINES AS CALCIUM CHANNEL BLOCKERS EURO CELTIQUE SA (LU) 2013-06-05 EP disclosed
US-20090105249-A1 4-phenylsulfonamidopiperidines as calcium channel blockers EURO-CELTIQUE S.A. (LU) 2009-04-23 US disclosed
CN-101044116-A 4-phenylsulfonamidopiperidines as calcium channel blockers EURO CELTIQUE SA (LU) 2007-09-26 CN disclosed
EP-1814851-A2 4-PHENYLSULFONAMIDOPIPERIDINES AS CALCIUM CHANNEL BLOCKERS EURO-CELTIQUE S.A. (LU) 2007-08-08 EP disclosed
WO-2006040181-A2 4-PHENYLSULFONAMIDOPIPERIDINES AS CALCIUM CHANNEL BLOCKERS EURO-CELTIQUE S.A. (LU) 2006-04-20 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-20090105249-A1 4-phenylsulfonamidopiperidines as calcium channel blockers CACNA1A, CACNA1E, CACNA1B ALDH1A1 2001/4885KDM4E 1434/4885CXCR4 1171/4885

“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.