SCHEMBL395972

SCHEMBL395972

O=C(c1cccc(S(=O)(=O)Nc2ccc(C(F)(F)F)cc2)c1)N1CCN2CCC[C@H]2C1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 1/20 0.69
ALDH1A1 P00352 2/20 0.58
KMT2A Q03164 3/20 0.57
LMNA P02545 2/20 0.57
HTT P42858 1/20 0.57
SIRT5 Q9NXA8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
PKM P14618 1/20 0.52
RAB9A P51151 1/20 0.52
POLB P06746 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CRHBP P24387 1/20 0.48
CRHR2 Q13324 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
TGFBR1 P36897 1/20 0.47

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
SCHEMBL399195 1.00 CACNA1H (0.69) CACNA1HALDH1A1KMT2ALMNAHTT
SCHEMBL398298 0.97 CACNA1H (0.65) CACNA1HALDH1A1KMT2ALMNAHTT
SCHEMBL396082 0.92 ALDH1A1 (0.70) CACNA1HALDH1A1KMT2ALMNAHTT
SCHEMBL15746822 0.92 ALDH1A1 (0.70) CACNA1HALDH1A1KMT2ALMNAHTT
SCHEMBL399539 0.90 CACNA1H (0.75) CACNA1HALDH1A1LMNAHTTSIRT5
SCHEMBL398997 0.89 ALDH1A1 (0.72) CACNA1HALDH1A1KMT2ALMNAHTT
SCHEMBL397752 0.88 ALDH1A1 (0.66) CACNA1HALDH1A1KMT2ALMNAHTT
SCHEMBL397289 0.87 ALDH1A1 (0.68) ALDH1A1KMT2ALMNAHTTL3MBTL1
SCHEMBL395605 0.85 CACNA1H (0.74) CACNA1HALDH1A1LMNAHTTSIRT5
SCHEMBL396044 0.85 CACNA1H (0.74) CACNA1HALDH1A1LMNAHTTSIRT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2382191-B1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBVIE BAHAMAS LTD (BS) 2014-11-12 EP claimed
US-20130210827-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBVIE INC. (US) 2013-08-15 US claimed
US-8101614-B2 Substituted pyrrolo [1,2-a] pyrazines as calcium channel blockers ABBOTT LABORATORIES (US) 2012-01-24 US claimed
US-20100197693-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBOTT LABORATORIES (US) 2010-08-05 US claimed
EP-2382191-B1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBVIE BAHAMAS LTD (BS) 2014-11-12 EP disclosed
US-8741899-B2 (4-chloro-2-fluoro-N-(2-fluorophenyl)-5-[(8aR)-hexahydropyrrolo-[1,2-a]pyrazin-2(1H)-ylcarbonyl]-benzenesulfonamide, and pharmaceutically acceptable salts thereof ABBVIE INC. (US) 2014-06-03 US disclosed
US-20130210827-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBVIE INC. (US) 2013-08-15 US disclosed
US-8101614-B2 Substituted pyrrolo [1,2-a] pyrazines as calcium channel blockers ABBOTT LABORATORIES (US) 2012-01-24 US disclosed
US-20100197693-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBOTT LABORATORIES (US) 2010-08-05 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 (2 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-20130210827-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS CACNA1E, RYR2, RYR1 CACNA1H 13/4885ALDH1A1 1038/4885KMT2A 4316/4885
US-20100197693-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS CACNA1E, RYR2, RYR1 CACNA1H 13/4885ALDH1A1 1038/4885KMT2A 4316/4885

“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.