SCHEMBL3910474

SCHEMBL3910474

COc1ccc(-c2ccc(C(CC(N)=O)C(=O)O)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.60
HTT P42858 1/20 0.60
LMNA P02545 1/20 0.59
FFAR1 O14842 1/20 0.52
ALOX5 P09917 1/20 0.51
TNF P01375 1/20 0.48
AKR1C3 P42330 3/20 0.48
AKR1C2 P52895 3/20 0.48
AKR1C1 Q04828 1/20 0.48
PTGS1 P23219 1/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
POLB P06746 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
LDHA P00338 1/20 0.45
CCKAR P32238 4/20 0.45

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
SCHEMBL4459742 0.84 TNF (0.52) GAAHTTLMNAFFAR1ALOX5
SCHEMBL7891728 0.82 L3MBTL1 (0.68) GAAHTTFFAR1AKR1C3AKR1C2
SCHEMBL3913073 0.81 GAA (0.53) GAAHTTLMNAAKR1C2AKR1C1
SCHEMBL27702953 0.80 TNF (0.55) GAAHTTLMNAFFAR1ALOX5
SCHEMBL3910097 0.80 GAA (0.51) GAAHTTLMNAL3MBTL1POLB
SCHEMBL8585877 0.80 L3MBTL1 (0.51) GAAHTTLMNAFFAR1AKR1C3
SCHEMBL31344401 0.79 AKR1C3 (0.54) GAAHTTAKR1C3AKR1C2AKR1C1
SCHEMBL21194023 0.79 AKR1C3 (0.54) GAAHTTAKR1C3AKR1C2AKR1C1
SCHEMBL7868149 0.79 FFAR1 (0.49) FFAR1ALOX5AKR1C3AKR1C2AKR1C1
SCHEMBL490727 0.77 AKR1C3 (0.55) FFAR1AKR1C3AKR1C2AKR1C1PTGS1

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-7476759-B2 e.g. 4-Amino-3-(4'-cyano-1,1'-biphenyl-4-yl)-4-oxobutanoic acid; antiinflammatory , anticarcinogenic, antiasthmatic agent; autoimmune disorder; osteoarthritis, rubella, Alzheimer's, Parkinson's diseases, epilepsy, osteoporosis GLAXO GROUP LIMITED (GB) 2009-01-13 US disclosed
US-20060235074-A1 Matrix metalloproteinase inhibitors GLAXO GROUP LIMITED (GB) 2006-10-19 US disclosed
EP-1654218-A2 MATRIX METALLOPROTEINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2006-05-10 EP disclosed
WO-2005016868-A2 MATRIX METALLOPROTEINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-02-24 WO 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-20060235074-A1 Matrix metalloproteinase inhibitors MMP13, MMP9, MMP24 GAA 1135/4885HTT 4566/4885LMNA 3007/4885

“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.