SCHEMBL19248495

SCHEMBL19248495

O=COCc1ccc(CC(=O)O)c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
AKR1B1 P15121 2/20 0.43
CAMK2A Q9UQM7 2/20 0.42
SRC P12931 2/20 0.39
CXCL8 P10145 3/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
FABP4 P15090 1/20 0.35
FABP5 Q01469 1/20 0.35
SLC1A3 P43003 1/20 0.35
SLC1A2 P43004 1/20 0.35
SLC1A1 P43005 1/20 0.35

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
SCHEMBL19248494 0.84 FFAR4 (0.46) AKR1B1
SCHEMBL19248492 0.83 MEN1 (0.47) AKR1B1ALDH1A1FABP4FABP5
SCHEMBL19248491 0.82 HMGB1 (0.41) SRCKDM4EALDH1A1HPGDHSD17B10
SCHEMBL29732929 0.82 TDP1 (0.69) TDP1AKR1B1CAMK2ACXCL8KDM4E
SCHEMBL69027 0.82 TDP1 (0.69) TDP1AKR1B1CAMK2ACXCL8KDM4E
SCHEMBL11306437 0.78 NPC1 (0.40) TDP1AKR1B1SRCSLC1A3SLC1A2
SCHEMBL21585561 0.76 TDP1 (0.62) TDP1AKR1B1CAMK2ACXCL8KDM4E
SCHEMBL2650202 0.76 TDP1 (0.53) TDP1AKR1B1CAMK2ASRCCXCL8
Phenylacetic Acid SCHEMBL30136468 0.74 AKR1B1 (0.63) AKR1B1CAMK2AALDH1A1GAA
SCHEMBL69234 0.73 TDP1 (0.76) TDP1AKR1B1CXCL8KDM4EGLA

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-20180093939-A9 NOVEL MONOMERS FROM BIOMASS NDSU RESEARCH FOUNDATION (US) 2018-04-05 US disclosed
US-20170233325-A1 NOVEL MONOMERS FROM BIOMASS NDSU RESEARCH FOUNDATION (US) 2017-08-17 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 (2 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-20180093939-A9 NOVEL MONOMERS FROM BIOMASS DCXR, MANBA, PGLS TDP1 2448/4885AKR1B1 1678/4885CAMK2A 2403/4885
US-20170233325-A1 NOVEL MONOMERS FROM BIOMASS DCXR, MANBA, PGLS TDP1 2448/4885AKR1B1 1678/4885CAMK2A 2403/4885

“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.