SCHEMBL5521792

SCHEMBL5521792

CC1(c2c(F)cccc2F)OC=CC1=O

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 13/20 0.51
HCAR3 P49019 9/20 0.51
CYP1A2 P05177 1/20 0.37
DRD2 P14416 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
BACE1 P56817 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 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
SCHEMBL5526802 0.82 HCAR2 (0.54) HCAR2HCAR3CYP1A2DRD2SIGMAR1
SCHEMBL11414250 0.76 HCAR2 (0.53) HCAR2HCAR3CYP1A2DRD2SIGMAR1
SCHEMBL3101214 0.71 HCAR2 (0.56) HCAR2HCAR3CYP1A2DRD2SIGMAR1
SCHEMBL5531839 0.70 HCAR2 (0.57) HCAR2HCAR3CYP1A2DRD2SIGMAR1
SCHEMBL3100362 0.69 HCAR2 (0.43) HCAR2HCAR3CYP1A2DRD2SIGMAR1
SCHEMBL3094399 0.69 HCAR2 (0.53) HCAR2HCAR3CYP1A2DRD2SIGMAR1
SCHEMBL3108537 0.68 HCAR2 (1.00) HCAR2HCAR3CYP1A2
SCHEMBL5524159 0.67 TP53 (0.40) HCAR2HCAR3CYP1A2DRD2SIGMAR1
SCHEMBL5522029 0.67 HCAR2 (0.41) HCAR2HCAR3CYP1A2BACE1
SCHEMBL183127 0.64

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070093545-A1 4-Oxo-4,5-dihydro-furan-2-carboxylic acid derivatives and methods of treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. (US) 2007-04-26 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-20070093545-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.