SCHEMBL7978345

SCHEMBL7978345

CCn1c(-c2ccc(C(N)=O)cc2)nnc1C(C)(C)Oc1ccc(F)cc1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACSS2 Q9NR19 1/20 0.41
PARP10 Q53GL7 2/20 0.40
MAOB P27338 1/20 0.40
ALPG P10696 1/20 0.39
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
FPR2 P25090 1/20 0.36
SCN9A Q15858 1/20 0.36
MAPK14 Q16539 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
SCHEMBL7981467 0.86 RORC (0.43) ACSS2MAPK14
SCHEMBL7992163 0.86 ACSS2 (0.43) ACSS2PARP10MAOBALDH1A1MAPT
SCHEMBL7979824 0.85 KDM4E (0.38) MAOBALDH1A1MAPTMEN1HPGD
SCHEMBL7982928 0.85 MAPK14 (0.39) ACSS2MAPK14
SCHEMBL7985159 0.84 MKNK1 (0.37)
SCHEMBL7981478 0.84 ACSS2 (0.38) ACSS2ALPGMAPK14
SCHEMBL7971539 0.84 ACSS2 (0.42) ACSS2ALDH1A1MAPTMEN1HPGD
SCHEMBL7988236 0.83 JAK2 (0.39) ACSS2ALPGMAPT
SCHEMBL1417571 0.82 ALPG (0.38) ALPG
SCHEMBL12671350 0.81 TSHR (0.37) ALDH1A1MEN1HPGDKMT2A

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 ACSS2 1337/4885PARP10 2809/4885MAOB 1184/4885

“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.