SCHEMBL4257673

SCHEMBL4257673

CCOc1ccc(C(=O)CCC(=O)OC)cc1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.70
HTT P42858 3/20 0.63
MAPK1 P28482 1/20 0.57
ATM Q13315 1/20 0.57
L3MBTL1 Q9Y468 3/20 0.56
GAA P10253 1/20 0.56
PLK1 P53350 1/20 0.56
ALDH1A1 P00352 4/20 0.55
KMT2A Q03164 3/20 0.55
MEN1 O00255 1/20 0.55
LMNA P02545 3/20 0.55
TP53 P04637 2/20 0.55
HPGD P15428 1/20 0.55
TSHR P16473 1/20 0.55
PARP10 Q53GL7 1/20 0.54
MAPT P10636 3/20 0.54
MMP1 P03956 1/20 0.54
HSD17B10 Q99714 2/20 0.54
USP2 O75604 1/20 0.54

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
SCHEMBL14375162 0.87 L3MBTL1 (0.71) NPC1HTTMAPK1ATML3MBTL1
SCHEMBL1108994 0.84 MMP1 (0.70) NPC1HTTMAPK1ALDH1A1KMT2A
SCHEMBL4262518 0.83 NPC1 (0.74) NPC1HTTL3MBTL1GAAALDH1A1
SCHEMBL19043207 0.83 NPC1 (0.74) NPC1HTTL3MBTL1GAAPLK1
SCHEMBL14375130 0.83 MAPT (0.58) NPC1HTTMAPK1ATML3MBTL1
SCHEMBL7627400 0.82 NPC1 (0.72) NPC1L3MBTL1PLK1ALDH1A1KMT2A
SCHEMBL10388116 0.81 MAPT (0.52) NPC1HTTL3MBTL1ALDH1A1KMT2A
SCHEMBL27796196 0.81 NPC1 (0.72) NPC1HTTL3MBTL1GAAPLK1
SCHEMBL17884768 0.80 ESRRB (0.62) L3MBTL1ALDH1A1MAPTMMP1
SCHEMBL3920266 0.80 KMT2A (0.57) NPC1MAPK1L3MBTL1ALDH1A1KMT2A

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
US-20090048258-A1 Amide Compound TAKEDA, PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-19 US disclosed
US-20090048258-A1 Amide Compound TAKEDA, PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-19 US disclosed
US-20090048258-A1 Amide Compound TAKEDA, PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-19 US disclosed
EP-1845081-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2007-10-17 EP 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-20090048258-A1 Amide Compound DLAT, DGAT1, DGAT2 NPC1 485/4885HTT 1132/4885MAPK1 2607/4885

“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.