SCHEMBL5010595

SCHEMBL5010595

COc1ccc(CNC(=O)c2cc(NC(=O)c3cc(F)c(F)cc3Cl)[nH]n2)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
NPC1 O15118 1/20 0.50
MAPT P10636 1/20 0.50
RAB9A P51151 1/20 0.50
ALDH1A1 P00352 2/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NOD2 Q9HC29 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
APEX1 P27695 1/20 0.45
GAA P10253 1/20 0.45
PYGL P06737 1/20 0.44
PPARG P37231 4/20 0.44
RECQL P46063 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL5008275 0.89 MAPT (0.48) NPC1MAPTRAB9AALDH1A1HTT
SCHEMBL13933540 0.88 NPC1 (0.43) LMNANPC1MAPTRAB9AALDH1A1
SCHEMBL5012182 0.87 PPARG (0.56) NPC1RAB9AMAPK1PPARG
SCHEMBL5010592 0.86 MAPT (0.51) MAPTRAB9AALDH1A1HTTMEN1
SCHEMBL14587643 0.86 PPARG (0.44) NPC1MAPTRAB9AALDH1A1HTT
SCHEMBL5010609 0.86 NPC1 (0.48) NPC1MAPTRAB9AALDH1A1MAPK1
SCHEMBL5012069 0.85 WDR5 (0.44) NPC1MAPTRAB9AHTTPPARG
SCHEMBL5010706 0.85 PPARG (0.47) NPC1MAPTRAB9AHTTPPARG
SCHEMBL5013431 0.85 NPC1 (0.49) NPC1MAPTRAB9AMAPK1L3MBTL1
SCHEMBL14587613 0.85 NTRK1 (0.54) NPC1MAPTRAB9AMAPK1SMN1; SMN2

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 6 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
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 LMNA 2123/4885NPC1 2838/4885MAPT 4621/4885

“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.