SCHEMBL7992173

SCHEMBL7992173

CCn1c(-c2ccc(N)cc2F)nnc1C(C)(C)Oc1ccc(Cl)cc1F

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.40
HPRT1 P00492 1/20 0.34
RORC P51449 1/20 0.32
S1PR4 O95977 1/20 0.32
PDE2A O00408 1/20 0.32
PDE10A Q9Y233 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
SCHEMBL7989328 0.93 HSD11B1 (0.39) HSD11B1HPRT1
SCHEMBL7988318 0.90 RORC (0.40) RORC
SCHEMBL7978690 0.88 HSD11B1 (0.36) HSD11B1
SCHEMBL7981464 0.88 KDM4E (0.36) HSD11B1RORCS1PR4
SCHEMBL7981732 0.88 HSD11B1 (0.47) HSD11B1
SCHEMBL7992166 0.86 HSD11B1 (0.37) HSD11B1RORC
SCHEMBL12671317 0.85 HSD11B1 (0.38) HSD11B1HPRT1
SCHEMBL7988390 0.85 HSD11B1 (0.38) HSD11B1RORC
SCHEMBL12677412 0.84 HSD11B1 (0.38) HSD11B1HPRT1
SCHEMBL7979711 0.82 HSD11B1 (0.36) 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 1/4885HPRT1 3743/4885RORC 574/4885

“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.