SCHEMBL3485983

SCHEMBL3485983

CC(C)CNC(=O)CCN1CCC(N(C(C)C)S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
UBE2M P61081 6/20 0.48
DCUN1D1 Q96GG9 6/20 0.48
CACNA1B Q00975 10/20 0.45
GAA P10253 2/20 0.44
HPGD P15428 1/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CACNA1C Q13936 1/20 0.43
NR1I2 O75469 1/20 0.42
CCR5 P51681 1/20 0.42
RORC P51449 1/20 0.42

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
SCHEMBL3485872 0.91 CACNA1B (0.47) UBE2MDCUN1D1CACNA1BGAAHPGD
SCHEMBL3485549 0.85 UBE2M (0.48) UBE2MDCUN1D1CACNA1BGAALMNA
SCHEMBL8082563 0.83 CACNA1B (0.48) UBE2MDCUN1D1CACNA1BGAAHPGD
SCHEMBL3762464 0.83 CACNA1B (0.46) UBE2MDCUN1D1CACNA1BGAAHPGD
SCHEMBL3484838 0.82 NPSR1 (0.53) UBE2MDCUN1D1CACNA1BLMNASMN1; SMN2
SCHEMBL8083318 0.82 CACNA1B (0.46) UBE2MDCUN1D1CACNA1BGAAHPGD
SCHEMBL13002406 0.81 CACNA1B (0.51) UBE2MDCUN1D1CACNA1BGAAHPGD
SCHEMBL3485159 0.80 CACNA1B (0.50) CACNA1BGAAHPGDCACNA1CNR1I2
SCHEMBL3485824 0.79 ALDH1A1 (0.52) UBE2MDCUN1D1CACNA1BLMNASMN1; SMN2
SCHEMBL3485265 0.79 ALDH1A1 (0.47) UBE2MDCUN1D1CACNA1BGAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8791264-B2 Benzenesulfonamide compounds and their use as blockers of calcium channels PURDUE PHARMA L.P. (US) 2014-07-29 US claimed
US-20100022595-A1 Benzenesulfonamide Compounds and Their Use as Blockers of Calcium Channels PURDUE PHARMA L.P. (CT) 2010-01-28 US claimed
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-20100022595-A1 Benzenesulfonamide Compounds and Their Use as Blockers of Calcium Channels PURDUE PHARMA L.P. (CT) 2010-01-28 US disclosed
US-20100022595-A1 Benzenesulfonamide Compounds and Their Use as Blockers of Calcium Channels PURDUE PHARMA L.P. (CT) 2010-01-28 US disclosed
US-20100022595-A1 Benzenesulfonamide Compounds and Their Use as Blockers of Calcium Channels PURDUE PHARMA L.P. (CT) 2010-01-28 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-2007118853-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS BLOCKERS OF CALCIUM CHANNELS EURO-CELTIQUE S.A. (LU) 2007-10-25 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-20100022595-A1 Benzenesulfonamide Compounds and Their Use as Blockers of Calcium Channels CACNA1A, CACNA1E, CACNA1B UBE2M 4024/4885DCUN1D1 3781/4885CACNA1B 3/4885

“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.