SCHEMBL7975235

SCHEMBL7975235

Cn1c(-c2ccc(C(=O)NCCO)cc2F)nnc1C(C)(C)Oc1c(F)cc(Cl)cc1F

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACSS2 Q9NR19 2/20 0.41
METAP2 P50579 1/20 0.40
MAPK11 Q15759 1/20 0.39
MAPK14 Q16539 1/20 0.39
MCHR1 Q99705 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL12671403 0.85 HSD11B1 (0.41) HTT
Clofutriben SCHEMBL1417758 0.84 HSD11B1 (0.40)
SCHEMBL7981409 0.80 HSD11B1 (0.42)
SCHEMBL7991823 0.78 HSD11B1 (0.46)
SCHEMBL7970366 0.78 HSD11B1 (0.40)
SCHEMBL29306610 0.77 HSD11B1 (0.45)
SCHEMBL12671034 0.76 MAPK14 (0.40) MAPK14
SCHEMBL1417698 0.76 SLC22A12 (0.38) MAPK14
SCHEMBL7991944 0.76 ESR2 (0.39) ACSS2MAPK14
SCHEMBL12671316 0.75 ACSS2 (0.36) ACSS2

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 ACSS2 1337/4885METAP2 2967/4885MAPK11 389/4885

“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.