SCHEMBL7967520

SCHEMBL7967520

C[C@H](Oc1ncc(C(N)=O)cc1Cl)c1nnc(-c2ccccc2Cl)n1C

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 10/20 0.42
RORC P51449 3/20 0.42
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
PDE2A O00408 1/20 0.35
PDE10A Q9Y233 1/20 0.35
S1PR1 P21453 1/20 0.35
S1PR5 Q9H228 1/20 0.35
RORB Q92753 1/20 0.35

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
SCHEMBL7988091 0.92 HSD11B1 (0.43) HSD11B1RORCLMNAMAPTTSHR
SCHEMBL7991818 0.89 HSD11B1 (0.46) HSD11B1RORC
SCHEMBL7977548 0.85 HSD11B1 (0.47) HSD11B1RORCLMNAMAPTTSHR
SCHEMBL7984073 0.84 HSD11B1 (0.44) HSD11B1RORCLMNAMAPTTSHR
SCHEMBL12671009 0.80 HSD11B1 (0.44) HSD11B1RORC
SCHEMBL7979284 0.80 HSD11B1 (0.45) HSD11B1RORCLMNAMAPTTSHR
SCHEMBL7984122 0.78 HSD11B1 (0.47) HSD11B1LMNAMAPTTSHRDPP4
SCHEMBL7980339 0.78 HSD11B1 (0.46) HSD11B1
SCHEMBL7979417 0.75 HSD11B1 (0.46) HSD11B1
SCHEMBL7987984 0.74 HSD11B1 (0.50) 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 5 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-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
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 1/4885RORC 574/4885LMNA 4210/4885

“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.