SCHEMBL5010377

SCHEMBL5010377

Nc1cc(F)c(F)cc1C(=O)Nc1cc(C(=O)O)n[nH]1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYTH3 O43739 1/20 0.38
BTK Q06187 1/20 0.38
EPN1 Q9Y6I3 1/20 0.38
HCAR2 Q8TDS4 8/20 0.37
DAO P14920 1/20 0.37
STING1 Q86WV6 6/20 0.36
PYGL P06737 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ASPH Q12797 1/20 0.36
KDM8 Q8N371 1/20 0.36
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
HCAR3 P49019 2/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL3822963 0.85 PYGL (0.50) PYGLNPC1RAB9A
SCHEMBL3825349 0.84 HCAR2 (0.44) CYTH3BTKEPN1HCAR2DAO
SCHEMBL5013483 0.81 GPR27 (0.44) CYTH3BTKEPN1HCAR2DAO
SCHEMBL5009899 0.81 STING1 (0.41) HCAR2DAOSTING1PYGLKDM4E
SCHEMBL5013495 0.80 PYGL (0.44) PYGLNPC1RAB9A
SCHEMBL5012235 0.80 KEAP1 (0.59) CYTH3BTKEPN1HCAR2DAO
SCHEMBL5008542 0.78 MEN1 (0.40) HCAR2DAOSTING1KDM4EHCAR3
SCHEMBL14587862 0.75 HTT (0.48) KDM4ERAB9A
Imidazole SCHEMBL3820589 0.75 PYGL (0.42) PYGLNPC1RAB9A
SCHEMBL14587833 0.74 PTGES (0.40) PYGLNPC1RAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP claimed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US claimed
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP disclosed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 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-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents PYGL, GYS2, AGL CYTH3 3210/4885BTK 2283/4885EPN1 2681/4885

“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.