SCHEMBL3134491

SCHEMBL3134491

COc1ccc(C(=O)[C@H](C)NC(=O)OC(C)(C)C)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NNMT P40261 2/20 0.49
TRPA1 O75762 2/20 0.44
MKNK1 Q9BUB5 1/20 0.42
MKNK2 Q9HBH9 1/20 0.42
GRN P28799 2/20 0.40
SORT1 Q99523 2/20 0.40
GPR119 Q8TDV5 1/20 0.39
GABRA1 P14867 1/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
ACACB O00763 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
KMT2A Q03164 2/20 0.37
HRH2 P25021 1/20 0.37
HRH1 P35367 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL30461933 0.82 NNMT (0.55) NNMTMKNK1MKNK2GRNSORT1
SCHEMBL15632156 0.81 PPARG (0.51) KDM4EALDH1A1HPGDPPARGPPARA
SCHEMBL837027 0.81 PPARG (0.51) KDM4EALDH1A1HPGDPPARGPPARA
SCHEMBL837026 0.81 PPARG (0.51) KDM4EALDH1A1HPGDPPARGPPARA
SCHEMBL6451903 0.79 NNMT (0.41) NNMTTRPA1MKNK1MKNK2GRN
SCHEMBL27405397 0.77 MIF (0.46) TRPA1KDM4EHPGDPPARGPPARA
SCHEMBL18660862 0.77 PPARG (0.49) TRPA1KDM4EALDH1A1HPGDPPARG
SCHEMBL27405399 0.77 MIF (0.46) TRPA1KDM4EHPGDPPARGPPARA
SCHEMBL18660861 0.77 PPARG (0.49) TRPA1KDM4EALDH1A1HPGDPPARG
SCHEMBL14395847 0.77 NAMPT (0.49) TRPA1KDM4EALDH1A1KMT2AMEN1

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-20100080786-A1 Phenyl or Pyridinyl Substituted Indazoles Derivatives ASTRAZENECA AB (SE) 2010-04-01 US disclosed
US-20100080786-A1 Phenyl or Pyridinyl Substituted Indazoles Derivatives ASTRAZENECA AB (SE) 2010-04-01 US disclosed
US-20100080786-A1 Phenyl or Pyridinyl Substituted Indazoles Derivatives ASTRAZENECA AB (SE) 2010-04-01 US 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-20100080786-A1 Phenyl or Pyridinyl Substituted Indazoles Derivatives CYP3A5, CYP3A43, ABCB1 NNMT 2157/4885TRPA1 1270/4885MKNK1 2966/4885

“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.