SCHEMBL26344969

SCHEMBL26344969

O=S(=O)(CCN1CCC(Cc2cc#ccc2)CC1)N1CCSc2ccccc2C1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RYR2 Q92736 6/20 0.61
KCNH2 Q12809 1/20 0.40
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CCR3 P51677 1/20 0.34
MAPT P10636 1/20 0.33
PRMT3 O60678 1/20 0.33
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
PRMT1 Q99873 1/20 0.33
PRMT8 Q9NR22 1/20 0.33

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
SCHEMBL6867136 0.88 RYR2 (0.76) RYR2KCNH2CYP1A2CYP2D6CYP2C9
SCHEMBL806929 0.76 RYR2 (1.00) RYR2KCNH2
SCHEMBL26345061 0.70 RYR2 (0.56) RYR2KCNH2
SCHEMBL13622077 0.70 RYR2 (0.52) RYR2MAPT
SCHEMBL7558332 0.69 RYR2 (0.53) RYR2MAPT
SCHEMBL6867427 0.66 KCNH2 (0.74) RYR2KCNH2
SCHEMBL13460725 0.65 RYR2 (0.53) RYR2CYP1A2CYP2D6CYP2C9CCR3
SCHEMBL13622172 0.64 RYR2 (0.53) RYR2CYP1A2CYP2D6CYP2C9
SCHEMBL13587293 0.64 RYR2 (0.58) RYR2KCNH2CYP1A2CYP2D6CYP2C9
SCHEMBL13309113 0.64 RYR2 (0.68) RYR2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230302013-A1 METHOD OF TREATING VIRAL-INDUCED COGNITIVE DYSFUNCTION BY TARGETING LEAKY RyR2 CHANNELS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2023-09-28 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-20230302013-A1 METHOD OF TREATING VIRAL-INDUCED COGNITIVE DYSFUNCTION BY TARGETING LEAKY RyR2 CHANNELS RYR2, RYR1, CACNB1 RYR2 1/4885KCNH2 293/4885CYP1A2 2650/4885

“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.