SCHEMBL20101722

SCHEMBL20101722

CCCSc1nc(N2CCC[C@H](COC=O)C2)ccc1C(=O)NC1CCCCC1

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 16/20 0.79
IDH1 O75874 4/20 0.67

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
SCHEMBL2009376 0.90 HSD11B1 (0.84) HSD11B1IDH1
SCHEMBL1971134 0.90 HSD11B1 (0.84) HSD11B1IDH1
Azd-4017 SCHEMBL1967349 0.88 HSD11B1 (1.00) HSD11B1IDH1
Azd-4017 SCHEMBL2006589 0.88 HSD11B1 (1.00) HSD11B1IDH1
Azd-4017 SCHEMBL1967884 0.88 HSD11B1 (1.00) HSD11B1IDH1
SCHEMBL3245313 0.88 HSD11B1 (0.84) HSD11B1IDH1
SCHEMBL14215682 0.85 HSD11B1 (0.79) HSD11B1IDH1
SCHEMBL1969653 0.85 HSD11B1 (0.84) HSD11B1IDH1
SCHEMBL26851808 0.84 HSD11B1 (0.83) HSD11B1IDH1
SCHEMBL13182706 0.84 HSD11B1 (0.83) HSD11B1IDH1

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-20180117065-A1 PHARMACEUTICAL COMPOSITIONS FOR COMBINATION THERAPY INTERCEPT PHARMACEUTICALS, INC. 2018-05-03 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-20180117065-A1 PHARMACEUTICAL COMPOSITIONS FOR COMBINATION THERAPY GPR119, FABP1, SLC10A1 HSD11B1 214/4885IDH1 2622/4885

“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.