SCHEMBL5576483

SCHEMBL5576483

CCOC(=O)c1cc2c(cc1C(=O)O)OCO2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
HSD17B10 Q99714 6/20 0.52
HPGD P15428 4/20 0.52
RAB9A P51151 5/20 0.48
MAPT P10636 3/20 0.48
TSHR P16473 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
NPC1 O15118 4/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2D6 P10635 2/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
HTT P42858 1/20 0.48
KDM4E B2RXH2 4/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
ALOX15 P16050 2/20 0.46
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.46

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
SCHEMBL11695937 0.85 ALDH1A1 (0.54) ALDH1A1HSD17B10HPGDRAB9AMAPT
SCHEMBL20740108 0.83 L3MBTL1 (0.54) ALDH1A1HSD17B10HPGDRAB9AMAPT
SCHEMBL8802888 0.83 ALDH1A1 (0.56) ALDH1A1HSD17B10HPGDRAB9AMAPT
SCHEMBL30996440 0.83 L3MBTL1 (0.54) ALDH1A1HSD17B10HPGDRAB9AMAPT
SCHEMBL337915 0.82 TSHR (0.57) ALDH1A1HSD17B10HPGDMAPTTSHR
SCHEMBL4952910 0.82 TSHR (0.57) ALDH1A1HSD17B10HPGDMAPTTSHR
SCHEMBL11576424 0.82 TSHR (0.57) ALDH1A1HSD17B10HPGDMAPTTSHR
SCHEMBL7263275 0.82 TSHR (0.57) ALDH1A1HSD17B10HPGDMAPTTSHR
SCHEMBL828639 0.82 TSHR (0.57) ALDH1A1HSD17B10HPGDMAPTTSHR
SCHEMBL11367616 0.81 ALDH1A1 (0.52) ALDH1A1HSD17B10HPGDRAB9AMAPT

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-20070117840-A1 Receptor antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-05-24 US disclosed
EP-1604983-A1 RECEPTOR ANTAGONIST Takeda Pharmaceutical Company Limited (JP) 2005-12-14 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-20070117840-A1 Receptor antagonist FSHR, NR4A1, GHRHR ALDH1A1 2961/4885HSD17B10 524/4885HPGD 765/4885

“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.