SCHEMBL12677397

SCHEMBL12677397

Cc1cc(F)c(OC(C)(C)c2nnc(-c3ccc(N)cc3F)n2C)c(F)c1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.36
KIT P10721 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
SCHEMBL7993122 0.93 HSD11B1 (0.36) HSD11B1KIT
SCHEMBL7985976 0.91 HSD11B1 (0.38) HSD11B1KIT
SCHEMBL7981154 0.83 HSD11B1 (0.36) HSD11B1KIT
SCHEMBL1417698 0.83 SLC22A12 (0.38) HSD11B1
SCHEMBL12671408 0.83 EGLN2 (0.37)
SCHEMBL12671096 0.83 HSD11B1 (0.40) HSD11B1
SCHEMBL7983930 0.82 HSD11B1 (0.37) HSD11B1
SCHEMBL12677300 0.81 MAPK14 (0.36) HSD11B1KIT
SCHEMBL7988964 0.81 HSD11B1 (0.35) HSD11B1
SCHEMBL7981732 0.80 HSD11B1 (0.47) HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 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 (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-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF HSD11B1, HSD11B2, HSD3B1 HSD11B1 1/4885KIT 4747/4885

“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.