SCHEMBL17523780

SCHEMBL17523780

CCN(CCCCCCCCCCC(C)(C)C)CC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.37
KCNH2 Q12809 1/20 0.31

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
SCHEMBL17523765 1.00 SIGMAR1 (0.37) SIGMAR1KCNH2
SCHEMBL15383401 1.00 SIGMAR1 (0.37) SIGMAR1KCNH2
SCHEMBL21015388 1.00 SIGMAR1 (0.37) SIGMAR1KCNH2
SCHEMBL15183494 0.98 SIGMAR1 (0.38) SIGMAR1
SCHEMBL15183480 0.91 CACNA2D1 (0.32) SIGMAR1
SCHEMBL17523776 0.89 SIGMAR1 (0.44) SIGMAR1KCNH2
SCHEMBL14731785 0.89 SIGMAR1 (0.44) SIGMAR1KCNH2
SCHEMBL21016075 0.89 SIGMAR1 (0.44) SIGMAR1KCNH2
SCHEMBL17523762 0.89 SIGMAR1 (0.44) SIGMAR1KCNH2
SCHEMBL8361776 0.86 SIGMAR1 (0.46) SIGMAR1KCNH2

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-20160039879-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL INC. (US) 2016-02-11 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-20160039879-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF FKBP1B, MALT1, FKBP5 SIGMAR1 3999/4885KCNH2 3628/4885

“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.