SCHEMBL7985488

SCHEMBL7985488

CC(C)n1c(-c2ccc(C(N)=O)cc2F)nnc1C(C)(C)Oc1ccc(F)cc1F

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 2/20 0.40
MAPK14 Q16539 5/20 0.39
BRD4 O60885 1/20 0.36

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
SCHEMBL7971468 0.92 MDM2 (0.37) PTGER1MAPK14
SCHEMBL7981358 0.91 MDM2 (0.39) BRD4
SCHEMBL7984317 0.89 MDM2 (0.34) PTGER1MAPK14
SCHEMBL12671358 0.89 SLC22A12 (0.36) PTGER1MAPK14
SCHEMBL12671311 0.88 MAPK14 (0.43) PTGER1MAPK14BRD4
SCHEMBL7981311 0.85 BRD4 (0.32) MAPK14BRD4
SCHEMBL1417622 0.85 RORC (0.42) PTGER1MAPK14
SCHEMBL7980781 0.84 SLC22A12 (0.35) PTGER1MAPK14
SCHEMBL1418168 0.83 OPRM1 (0.38) PTGER1MAPK14
SCHEMBL7985480 0.83 MDM2 (0.36)

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 PTGER1 1624/4885MAPK14 583/4885BRD4 1594/4885

“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.