SCHEMBL3485844

SCHEMBL3485844

CC(C)N(C1CCN(CC(=O)N(C)c2ccc(F)cc2)CC1)S(=O)(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 13/20 0.47
GAA P10253 2/20 0.46
HPGD P15428 1/20 0.46
NR1I2 O75469 3/20 0.46
CYP3A4 P08684 1/20 0.46
CACNA1C Q13936 1/20 0.44
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RORC P51449 1/20 0.41
KMT2A Q03164 1/20 0.41
TSHR P16473 1/20 0.41
HTR6 P50406 1/20 0.41
POLQ O75417 1/20 0.41

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
SCHEMBL3485156 0.92 CACNA1B (0.47) CACNA1BGAAHPGDNR1I2CYP3A4
SCHEMBL13541704 0.89 DRD2 (0.47) GAALMNARORC
SCHEMBL3485918 0.84 TSHR (0.56) CACNA1BNR1I2CYP3A4LMNASMN1; SMN2
SCHEMBL13002406 0.84 CACNA1B (0.51) CACNA1BGAAHPGDNR1I2CYP3A4
SCHEMBL3485159 0.83 CACNA1B (0.50) CACNA1BGAAHPGDNR1I2CYP3A4
SCHEMBL3485141 0.83 POLB (0.49) CACNA1BNR1I2CYP3A4LMNASMN1; SMN2
SCHEMBL8086157 0.82 CACNA1B (0.49) CACNA1BGAAHPGDNR1I2CACNA1C
SCHEMBL3485611 0.81 CACNA1B (0.47) CACNA1BGAAHPGDNR1I2CYP3A4
SCHEMBL3765000 0.81 CACNA1B (0.48) CACNA1BGAAHPGDNR1I2CYP3A4
SCHEMBL3763660 0.80 CACNA1B (0.47) CACNA1BGAAHPGDNR1I2CYP3A4

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 7 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
WO-2007118853-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS BLOCKERS OF CALCIUM CHANNELS EURO-CELTIQUE S.A. (LU) 2007-10-25 WO 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-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 CACNA1B 3/4885GAA 1863/4885HPGD 1408/4885

“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.