SCHEMBL7970837

SCHEMBL7970837

CC(C)(Oc1ccc(F)cc1)c1nnc(-c2ccc(C(N)=O)cc2F)n1C1CC1

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
GPR119 Q8TDV5 2/20 0.36
MAP3K14 Q99558 1/20 0.35
SCN9A Q15858 1/20 0.35
SLC22A12 Q96S37 1/20 0.35
MAPK14 Q16539 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
SCHEMBL12671342 0.91 SCN9A (0.37) MEN1KMT2AMAP3K14SCN9A
SCHEMBL1418168 0.89 OPRM1 (0.38) MAP3K14MAPK14
SCHEMBL7978689 0.89 GPR119 (0.36) MEN1POLBKMT2AGPR119SLC22A12
SCHEMBL7979761 0.87 OPRM1 (0.37) MEN1POLBKMT2AGPR119SLC22A12
SCHEMBL7984202 0.87 OPRM1 (0.36)
SCHEMBL12671326 0.86 MAPK14 (0.40) SLC22A12MAPK14
SCHEMBL7982146 0.85 CYP11B1 (0.32) MEN1POLBKMT2A
SCHEMBL12671320 0.85 PARP1 (0.37) GPR119
SCHEMBL7980107 0.84 OPRM1 (0.39)
SCHEMBL7992163 0.83 ACSS2 (0.43) MEN1KMT2ASLC22A12MAPK14

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 MEN1 2484/4885POLB 2414/4885KMT2A 2930/4885

“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.