SCHEMBL4640781

SCHEMBL4640781

CC(=O)c1cc2ccc(=O)oc2cc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 13/20 1.00
CA12 O43570 8/20 0.66
KDM4E B2RXH2 6/20 0.66
GLA P06280 5/20 0.66
GAA P10253 5/20 0.66
AKR1B1 P15121 4/20 0.66
MCL1 Q07820 4/20 0.66
MAPT P10636 3/20 0.66
ALDH1A1 P00352 3/20 0.66
HPGD P15428 3/20 0.66
CASP1 P29466 3/20 0.66
CASP7 P55210 3/20 0.66
HSD17B10 Q99714 3/20 0.66
ERAP1 Q9NZ08 3/20 0.66
CYP1A2 P05177 2/20 0.66
HIF1A Q16665 2/20 0.66
LMNA P02545 2/20 0.66
CYP3A4 P08684 2/20 0.66
BCHE P06276 1/20 0.66
ALOX15 P16050 1/20 0.66

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
SCHEMBL15842844 0.88 CA9 (0.78) CA9CA12KDM4EGLAGAA
Esculetin SCHEMBL6703123 0.84 CA9 (0.85) CA9CA12KDM4EGLAGAA
Esculetin SCHEMBL8528963 0.83 CA9 (0.82) CA9CA12KDM4EGLAGAA
Esculetin SCHEMBL24641 0.80 CA9 (1.00) CA9CA12KDM4EGLAGAA
Esculetin SCHEMBL6867015 0.80 CA9 (1.00) CA9CA12KDM4EGLAGAA
Esculetin SCHEMBL29569228 0.80 CA9 (1.00) CA9CA12KDM4EGLAGAA
Esculetin SCHEMBL30120615 0.78 CA9 (0.96) CA9CA12KDM4EGLAGAA
Esculetin SCHEMBL29163498 0.78 CA9 (0.96) CA9CA12KDM4EGLAGAA
Esculetin SCHEMBL8708221 0.78 CA9 (0.96) CA9CA12KDM4EGLAGAA
Esculetin SCHEMBL1736697 0.78 CA9 (0.96) CA9CA12KDM4EGLAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118459444-A Two hydroxyl-containing 6-dihydropyrazolyl coumarin compounds and preparation method thereof 河南中烟工业有限责任公司 2024-08-09 CN disclosed
CN-118459444-A Two hydroxyl-containing 6-dihydropyrazolyl coumarin compounds and preparation method thereof 河南中烟工业有限责任公司 2024-08-09 CN disclosed
EP-1667999-A4 BENZOPYRANONE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH SIGNAL PHARM LLC (US) 2008-08-06 EP disclosed
US-7247646-B2 Benzopyranone compounds, compositions thereof, and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC (US) 2007-07-24 US disclosed
EP-1667999-A1 BENZOPYRANONE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH Signal Pharmaceuticals LLC (US) 2006-06-14 EP disclosed
US-20050137231-A1 Benzopyranone compounds, compositions thereof, and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC 2005-06-23 US disclosed
WO-2005028472-A1 BENZOPYRANONE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC (US) 2005-03-31 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-20050137231-A1 Benzopyranone compounds, compositions thereof, and methods of treatment therewith ESR1, ESR2, ESRRG CA9 4036/4885CA12 4374/4885KDM4E 1097/4885

“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.