SCHEMBL17259229

SCHEMBL17259229

Cc1c(CNS(=O)(=O)c2ccccc2)nn(-c2ccccc2)c1CC(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 5/20 1.00
KCNH2 Q12809 5/20 0.60
CACNA1G O43497 4/20 0.60
HTR6 P50406 7/20 0.51
POLB P06746 2/20 0.41
KEAP1 Q14145 1/20 0.40
GLA P06280 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL17259219 0.88 CACNA1H (0.79) CACNA1HKCNH2CACNA1GHTR6THRB
SCHEMBL17259265 0.86 CACNA1H (0.76) CACNA1HKCNH2CACNA1GHTR6POLB
SCHEMBL17259256 0.80 CACNA1H (0.67) CACNA1HKCNH2CACNA1GHTR6POLB
SCHEMBL17259270 0.76 CACNA1H (0.60) CACNA1HKCNH2CACNA1GHTR6POLB
SCHEMBL17259260 0.75 KCNH2 (1.00) CACNA1HKCNH2CACNA1GHTR6
SCHEMBL17259246 0.72 KCNH2 (0.87) CACNA1HKCNH2CACNA1GHTR6
SCHEMBL23401061 0.70 CACNA1H (0.53) CACNA1HKCNH2CACNA1GHTR6POLB
SCHEMBL17259234 0.70 CACNA1H (0.53) CACNA1HKCNH2CACNA1GHTR6POLB
SCHEMBL17259274 0.69 KCNH2 (0.85) CACNA1HKCNH2CACNA1GHTR6
SCHEMBL17259308 0.69 KCNH2 (0.85) CACNA1HKCNH2CACNA1GHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9493423-B2 Compounds capable of inhibiting voltage gated calcium ion channel, and pharmaceutical compositions comprising the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-11-15 US claimed
US-20150329533-A1 COMPOUNDS CAPABLE OF INHIBITING VOLTAGE GATED CALCIUM ION CHANNEL, AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-11-19 US claimed
US-9493423-B2 Compounds capable of inhibiting voltage gated calcium ion channel, and pharmaceutical compositions comprising the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-11-15 US disclosed
US-20150329533-A1 COMPOUNDS CAPABLE OF INHIBITING VOLTAGE GATED CALCIUM ION CHANNEL, AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-11-19 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-20150329533-A1 COMPOUNDS CAPABLE OF INHIBITING VOLTAGE GATED CALCIUM ION CHANNEL, AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME CACNA1B, CACNA1F, CACNA1G CACNA1H 9/4885KCNH2 33/4885CACNA1G 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.