SCHEMBL4424696

SCHEMBL4424696

O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC(N(C2CC2)S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 19/20 0.80
NR1I2 O75469 9/20 0.65
CYP3A4 P08684 1/20 0.65
HSD11B1 P28845 1/20 0.55

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
SCHEMBL4395827 0.84 CACNA1B (0.75) CACNA1BNR1I2CYP3A4
SCHEMBL4286190 0.84 CACNA1B (0.84) CACNA1BNR1I2CYP3A4
SCHEMBL4277896 0.81 CACNA1B (0.61) CACNA1BNR1I2CYP3A4
SCHEMBL13932902 0.81 CACNA1B (0.68) CACNA1BNR1I2CYP3A4
SCHEMBL4277775 0.81 CACNA1B (0.60) CACNA1BNR1I2CYP3A4
SCHEMBL4396733 0.80 CACNA1B (0.69) CACNA1BNR1I2CYP3A4
SCHEMBL4284463 0.80 CACNA1B (0.73) CACNA1BNR1I2CYP3A4
SCHEMBL3486136 0.80 CACNA1B (0.68) CACNA1BNR1I2CYP3A4
SCHEMBL13932893 0.80 CACNA1B (0.68) CACNA1BNR1I2CYP3A4
SCHEMBL4389869 0.79 CACNA1B (0.70) CACNA1BNR1I2CYP3A4

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 5 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
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 CACNA1B 3/4885NR1I2 1898/4885CYP3A4 1097/4885

“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.