SCHEMBL14587669

SCHEMBL14587669

O=C(NCc1ccc(-n2cccn2)nc1)c1cc(NC(=O)c2cc(F)c(F)cc2Cl)[nH]n1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 3/20 0.48
NAMPT P43490 1/20 0.44
NTRK1 P04629 9/20 0.43
PPARG P37231 2/20 0.43
EGLN1 Q9GZT9 1/20 0.42
RET P07949 2/20 0.41
PI4KB Q9UBF8 1/20 0.41

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
SCHEMBL14587790 0.84 KLKB1 (0.44) NAMPTNTRK1PPARG
SCHEMBL14587777 0.83 KLKB1 (0.44) NTRK1PPARG
SCHEMBL14587697 0.83 PPARG (0.46) NTRK1PPARG
SCHEMBL14301499 0.83 PPARG (0.46) NTRK1PPARG
SCHEMBL14587664 0.83 PPARG (0.42) NAMPTNTRK1PPARG
SCHEMBL14587778 0.83 PPARG (0.52) NAMPTNTRK1PPARG
SCHEMBL14587789 0.82 KLKB1 (0.48) NTRK1PPARG
SCHEMBL14587673 0.82 PPARG (0.42) NTRK1PPARG
SCHEMBL14587679 0.81 PPARG (0.42) NTRK1PPARG
SCHEMBL5013662 0.81 PPARG (0.48) PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US 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 MERTK 3313/4885NAMPT 2652/4885NTRK1 4549/4885

“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.