SCHEMBL3094399

SCHEMBL3094399

CC1(c2ccco2)OC=CC1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.53
HCAR3 P49019 1/20 0.36
CYP1A2 P05177 1/20 0.36
ALDH1A1 P00352 2/20 0.33
DRD2 P14416 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPC1 O15118 1/20 0.31
KIF11 P52732 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TP53 P04637 1/20 0.30
NR3C1 P04150 1/20 0.30
PGR P06401 1/20 0.30
NR3C2 P08235 1/20 0.30
AR P10275 1/20 0.30

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
SCHEMBL11414250 0.75 HCAR2 (0.53) HCAR2HCAR3CYP1A2ALDH1A1DRD2
SCHEMBL5521792 0.69 HCAR2 (0.51) HCAR2HCAR3CYP1A2ALDH1A1DRD2
SCHEMBL3108632 0.69 HCAR2 (1.00) HCAR2HCAR3CYP1A2
SCHEMBL5526802 0.67 HCAR2 (0.54) HCAR2HCAR3CYP1A2ALDH1A1DRD2
SCHEMBL3101214 0.67 HCAR2 (0.56) HCAR2HCAR3CYP1A2DRD2SIGMAR1
SCHEMBL5531839 0.66 HCAR2 (0.57) HCAR2HCAR3CYP1A2DRD2SIGMAR1
SCHEMBL3100362 0.65 HCAR2 (0.43) HCAR2HCAR3CYP1A2ALDH1A1DRD2
SCHEMBL28622348 0.65
SCHEMBL15620214 0.64 HCAR2 (0.48) HCAR2ALDH1A1MEN1POLBMAPT
SCHEMBL3823868 0.63 HCAR2 (0.64) HCAR2HCAR3CYP1A2

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-7803837-B2 4-oxo-4,5-dihydro-furan-2-carboxylic acid derivatives and methods of treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. (US) 2010-09-28 US disclosed
US-20070161701-A1 4-oxo-4,5-dihydro-furan-2-carboxylic acid derivatives and methods of treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. 2007-07-12 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-20070161701-A1 4-oxo-4,5-dihydro-furan-2-carboxylic acid derivatives and methods of treatment of metabolic-related disorders thereof ABAT, G6PD, GLS2 HCAR2 229/4885HCAR3 373/4885CYP1A2 172/4885

“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.