SCHEMBL3485825

SCHEMBL3485825

O=S(=O)(c1cccc(C(F)(F)F)c1)N(C1CCNCC1)C1CC1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 18/20 0.55
NR1I2 O75469 9/20 0.53
CYP3A4 P08684 1/20 0.51
HTR2C P28335 1/20 0.50

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
SCHEMBL8225052 0.86 CACNA1B (0.51) CACNA1BNR1I2CYP3A4
SCHEMBL3486163 0.85 CACNA1B (0.55) CACNA1BHTR2C
Hydrochloric Acid SCHEMBL4275282 0.85 CACNA1B (0.50) CACNA1BNR1I2CYP3A4
SCHEMBL3958286 0.84 CACNA1B (0.55) CACNA1BNR1I2CYP3A4
SCHEMBL3485433 0.83 HTR2C (0.50) CACNA1BNR1I2CYP3A4HTR2C
SCHEMBL3485506 0.83 SLC6A2 (0.50) CACNA1BNR1I2HTR2C
SCHEMBL3485485 0.81 HTR2C (0.50) CYP3A4HTR2C
SCHEMBL3486045 0.81 HTR2C (0.51) CACNA1BHTR2C
SCHEMBL8269773 0.80 CACNA1B (0.60) CACNA1BNR1I2CYP3A4
SCHEMBL532533 0.79 KDM4E (0.46) HTR2C

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 37 patents — showing the first 20. 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
US-9000174-B2 4-phenylsulfonamidopiperidines as calcium channel blockers PURDUE PHARMA L.P. (US) 2015-04-07 US disclosed
US-9000174-B2 4-phenylsulfonamidopiperidines as calcium channel blockers PURDUE PHARMA L.P. (US) 2015-04-07 US disclosed
US-8937181-B2 Benzenesulfonamide compounds and the use thereof PURDUE PHARMA L.P. (US) 2015-01-20 US disclosed
US-8937181-B2 Benzenesulfonamide compounds and the use thereof PURDUE PHARMA L.P. (US) 2015-01-20 US disclosed
US-8937181-B2 Benzenesulfonamide compounds and the use thereof PURDUE PHARMA L.P. (US) 2015-01-20 US disclosed
US-8791264-B2 Benzenesulfonamide compounds and their use as blockers of calcium channels PURDUE PHARMA L.P. (US) 2014-07-29 US disclosed
US-8791264-B2 Benzenesulfonamide compounds and their use as blockers of calcium channels PURDUE PHARMA L.P. (US) 2014-07-29 US disclosed
US-8791264-B2 Benzenesulfonamide compounds and their use as blockers of calcium channels PURDUE PHARMA L.P. (US) 2014-07-29 US disclosed
US-8765736-B2 Benzenesulfonamide compounds and the use thereof PURDUE PHARMA L.P. (US) 2014-07-01 US disclosed
US-20090048227-A1 Substituted-1-Phthalazinamines As Vr- 1 Antagonists MERCK SHARP & DOHME CORP. 2009-02-19 US disclosed
WO-2007118853-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS BLOCKERS OF CALCIUM CHANNELS EURO-CELTIQUE S.A. (LU) 2007-10-25 WO disclosed
WO-2007118854-A1 BENZENESULFONAMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2007-10-25 WO disclosed
WO-2007118854-A1 BENZENESULFONAMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2007-10-25 WO disclosed
WO-2007118853-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS BLOCKERS OF CALCIUM CHANNELS EURO-CELTIQUE S.A. (LU) 2007-10-25 WO 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-2007075524-A2 SUBSTITUTED PIPERIDINES AS CALCIUM CHANNEL BLOCKERS MERCK & CO., INC. (US) 2007-07-05 WO disclosed
WO-2006040181-A2 4-PHENYLSULFONAMIDOPIPERIDINES AS CALCIUM CHANNEL BLOCKERS EURO-CELTIQUE S.A. (LU) 2006-04-20 WO 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-20090048227-A1 Substituted-1-Phthalazinamines As Vr- 1 Antagonists TRPV1, TRPV2, TRPV5 CACNA1B 36/4885NR1I2 322/4885CYP3A4 2097/4885

“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.