SCHEMBL4283320

SCHEMBL4283320

O=C(CC=C(c1ccc(F)cc1)c1ccc(F)cc1)N1CCC(N(C2CC2)S(=O)(=O)c2ccccc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 12/20 0.43
NR1I2 O75469 3/20 0.43
CYP3A4 P08684 1/20 0.43
HTR2A P28223 2/20 0.42
HTR2C P28335 1/20 0.42
KCNH2 Q12809 1/20 0.42
ALDH1A1 P00352 2/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ATM Q13315 1/20 0.41
TAS2R14 Q9NYV8 1/20 0.41
DRD2 P14416 1/20 0.39
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HSD11B1 P28845 1/20 0.39

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
SCHEMBL4277775 0.88 CACNA1B (0.60) CACNA1BNR1I2CYP3A4
SCHEMBL4284391 0.84 KMT2A (0.56) CACNA1BNR1I2CYP3A4HTR2AHTR2C
SCHEMBL4277600 0.81 CACNA1B (0.60) CACNA1BNR1I2CYP3A4HTR2AHTR2C
SCHEMBL3484949 0.78 ALDH1A1 (0.43) CACNA1BNR1I2CYP3A4HTR2AALDH1A1
SCHEMBL4279439 0.75 DRD2 (0.70) HTR2AKCNH2DRD2
SCHEMBL13932861 0.75 CACNA1B (0.57) CACNA1BNR1I2L3MBTL1
SCHEMBL4282408 0.74 CACNA1B (0.56) CACNA1BNR1I2CYP3A4HTR2AHTR2C
SCHEMBL14997383 0.73 CACNA1B (0.51) CACNA1BNR1I2CYP3A4
SCHEMBL4277896 0.73 CACNA1B (0.61) CACNA1BNR1I2CYP3A4
SCHEMBL3485444 0.72 LMNA (0.57) ALDH1A1ATMGAAL3MBTL1

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.