SCHEMBL7980987

SCHEMBL7980987

CC(=O)NCc1cc(Cl)ccc1OC(C)(C)c1nnc(-c2ccccc2C(F)(F)F)n1C

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 15/20 0.48
SETDB1 Q15047 1/20 0.42
HSD11B2 P80365 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
Hydrochloric Acid SCHEMBL1417572 0.99 HSD11B1 (0.48) HSD11B1SETDB1HSD11B2
SCHEMBL7967779 0.86 HSD11B1 (0.54) HSD11B1HSD11B2
SCHEMBL7977746 0.86 HSD11B1 (0.48) HSD11B1HSD11B2
Hydrochloric Acid SCHEMBL1417744 0.86 HSD11B1 (0.53) HSD11B1HSD11B2
Hydrochloric Acid SCHEMBL1417671 0.85 HSD11B1 (0.48) HSD11B1HSD11B2
SCHEMBL12671213 0.85 HSD11B1 (0.54) HSD11B1
SCHEMBL1417960 0.85 HSD11B1 (0.54) HSD11B1HSD11B2
Hydrochloric Acid SCHEMBL1418268 0.84 HSD11B1 (0.53) HSD11B1
SCHEMBL7988240 0.83 HSD11B1 (0.49) HSD11B1HSD11B2
SCHEMBL1417727 0.83 HSD11B1 (0.51) HSD11B1HSD11B2

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 3 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
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 WO 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 1/4885SETDB1 2883/4885HSD11B2 2/4885

“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.