SCHEMBL14587643

SCHEMBL14587643

COC(=O)c1ccc(CNC(=O)c2cc(NC(=O)c3cc(F)c(F)cc3Cl)[nH]n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.44
ALDH1A1 P00352 1/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
NR1I2 O75469 1/20 0.41
MAPT P10636 1/20 0.41
NAMPT P43490 1/20 0.41
NR1H4 Q96RI1 1/20 0.40
HTT P42858 1/20 0.39
RECQL P46063 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL5013522 0.92 CNR1 (0.44) PPARGALDH1A1NR1I2MAPTNAMPT
SCHEMBL5010706 0.90 PPARG (0.47) PPARGNPC1RAB9ANR1I2MAPT
SCHEMBL5010891 0.90 CCR1 (0.45) PPARGALDH1A1NPC1RAB9AMAPT
SCHEMBL5008275 0.89 MAPT (0.48) PPARGALDH1A1NPC1RAB9ANR1I2
SCHEMBL5010546 0.89 PPARG (0.48) PPARGNR1H4
SCHEMBL5008508 0.89 GAA (0.45) PPARGNPC1RAB9ANR1I2MAPT
SCHEMBL5012114 0.89 PPARG (0.45) PPARGNR1I2NR1H4
SCHEMBL5012304 0.88 PPARG (0.45) PPARGNR1I2NR1H4
SCHEMBL5013431 0.88 NPC1 (0.49) PPARGNPC1RAB9ANR1I2MAPT
SCHEMBL5008489 0.88 PPARG (0.51) PPARGNPC1RAB9ACYP2C9

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 PPARG 706/4885ALDH1A1 1278/4885NPC1 2838/4885

“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.