SCHEMBL14587772

SCHEMBL14587772

NCc1ccnc(CNC(=O)c2cc(NC(=O)c3cc(F)c(F)cc3Cl)[nH]n2)c1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
LOXL2 Q9Y4K0 2/20 0.42
PPARG P37231 3/20 0.42
NTRK1 P04629 11/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PYGL P06737 1/20 0.38

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
SCHEMBL14587693 0.88 RAB9A (0.46) ALDH1A1PPARGNTRK1MEN1KMT2A
SCHEMBL14587722 0.85 NTRK1 (0.54) ALDH1A1PPARGNTRK1NPC1RAB9A
SCHEMBL14587735 0.85 NTRK1 (0.54) ALDH1A1PPARGNTRK1NPC1RAB9A
SCHEMBL14587641 0.84 PPARG (0.41) ALDH1A1PPARGNTRK1
SCHEMBL14587723 0.84 PPARG (0.47) PPARGMEN1KMT2A
SCHEMBL14587681 0.83 NTRK1 (0.51) ALDH1A1PPARGNTRK1MEN1KMT2A
SCHEMBL14587849 0.82 PPARG (0.43) ALDH1A1PPARGNTRK1MEN1KMT2A
SCHEMBL14587847 0.81 PPARG (0.44) ALDH1A1PPARGNTRK1MEN1KMT2A
SCHEMBL5010627 0.81 PPARG (0.47) PPARGNTRK1NPC1RAB9APYGL
SCHEMBL5008489 0.81 PPARG (0.51) PPARGMEN1KMT2ANPC1RAB9A

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 ALDH1A1 1278/4885LOXL2 3298/4885PPARG 706/4885

“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.