SCHEMBL7979711

SCHEMBL7979711

CC(C)(Oc1ccc(Cl)cc1F)c1nnc(-c2ccc(N)cc2F)n1C1CC1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.36
ALDH1A1 P00352 1/20 0.33
HPRT1 P00492 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD11B2 P80365 1/20 0.32

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
SCHEMBL7968275 0.93 HSD11B2 (0.39) HSD11B1HSD11B2
SCHEMBL7992171 0.90 CYP11B1 (0.35) ALDH1A1
SCHEMBL7981764 0.88 HSD11B1 (0.33) HSD11B1ALDH1A1HSD11B2
SCHEMBL7981367 0.88 ALDH1A1 (0.33) ALDH1A1
SCHEMBL7978100 0.88 HSD11B1 (0.33) HSD11B1ALDH1A1HSD11B2
SCHEMBL7980107 0.86 OPRM1 (0.39) HSD11B1ALDH1A1
SCHEMBL12671306 0.86 GPR6 (0.36) HSD11B1
SCHEMBL7981732 0.86 HSD11B1 (0.47) HSD11B1HSD11B2
SCHEMBL7977941 0.86 HSD11B1 (0.35) HSD11B1ALDH1A1HSD11B2
SCHEMBL12677412 0.82 HSD11B1 (0.38) HSD11B1HPRT1

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 1/4885ALDH1A1 359/4885HPRT1 3743/4885

“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.