SCHEMBL7989328

SCHEMBL7989328

CCn1c(-c2ccc(N)cc2Cl)nnc1C(C)(C)Oc1ccc(Cl)cc1F

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.39
HSD11B2 P80365 1/20 0.36
HPRT1 P00492 1/20 0.34
CRHR1 P34998 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
SCHEMBL7992173 0.93 HSD11B1 (0.40) HSD11B1HPRT1
SCHEMBL7988390 0.92 HSD11B1 (0.38) HSD11B1HSD11B2
SCHEMBL12677424 0.88 HSD11B1 (0.47) HSD11B1HSD11B2
SCHEMBL7981464 0.87 KDM4E (0.36) HSD11B1
SCHEMBL7981156 0.86 HSD11B1 (0.36) HSD11B1
SCHEMBL12671321 0.86 HSD11B1 (0.38) HSD11B1HPRT1
SCHEMBL7978754 0.84 HSD11B1 (0.35) HSD11B1HSD11B2
SCHEMBL7985259 0.83 HSD11B1 (0.38) HSD11B1HSD11B2
SCHEMBL7988318 0.83 RORC (0.40)
SCHEMBL7968275 0.83 HSD11B2 (0.39) 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 1/4885HSD11B2 2/4885HPRT1 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.