SCHEMBL4285261

SCHEMBL4285261

C=C(Cc1ccc(N(C)C)cc1)N1CCC(N(C2CC2)S(=O)(=O)c2ccccc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 7/20 0.46
HTR2A P28223 4/20 0.43
HTR2C P28335 3/20 0.43
CCR5 P51681 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
RXFP1 Q9HBX9 1/20 0.40
CNR2 P34972 1/20 0.40
ALDH1A1 P00352 4/20 0.39
LMNA P02545 1/20 0.39
CHRM1 P11229 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP13 P45452 1/20 0.39
NR1I2 O75469 3/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL4282387 0.82 ALDH1A1 (0.51) CACNA1BHTR2AHTR2CALDH1A1KDM4E
SCHEMBL13932861 0.71 CACNA1B (0.57) CACNA1BLMNANR1I2SMN1; SMN2
SCHEMBL13880078 0.71 HTR2A (0.51) CACNA1BHTR2AHTR2CCCR5MEN1
SCHEMBL14997384 0.70 HTR2A (0.61) CACNA1BHTR2ASMN1; SMN2
SCHEMBL3484986 0.69 ALDH1A1 (0.51) CCR5MEN1KMT2AALDH1A1LMNA
SCHEMBL3484949 0.69 ALDH1A1 (0.43) CACNA1BHTR2AMEN1KMT2AALDH1A1
SCHEMBL4281379 0.69 CACNA1B (0.67) CACNA1BNR1I2
SCHEMBL4285276 0.69 CHRM4 (0.56) CACNA1BHTR2AHTR2C
SCHEMBL4286101 0.68 CACNA1B (0.49) CACNA1BHTR2AHTR2CKMT2ANR1I2
SCHEMBL4277519 0.68 CACNA1B (0.49) CACNA1BHTR2AHTR2CKMT2ANR1I2

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 3 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

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 3/4885HTR2A 1261/4885HTR2C 1132/4885

“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.