SCHEMBL3905573

SCHEMBL3905573

COCOc1ccc(C=O)c(OC)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.69
MAOB P27338 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
CYP1A2 P05177 7/20 0.49
CYP1A1 P04798 6/20 0.49
CYP1B1 Q16678 6/20 0.49
TUBB1 Q9H4B7 1/20 0.48
KDM4E B2RXH2 1/20 0.47
TSHR P16473 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
TRIM24 O15164 1/20 0.45
TYR P14679 1/20 0.45
TRIM33 Q9UPN9 1/20 0.45
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
NFE2L2 Q16236 2/20 0.44
ERN1 O75460 1/20 0.43
LMNA P02545 1/20 0.42
CYP2C9 P11712 1/20 0.42

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
SCHEMBL3200445 0.92 ALDH1A1 (0.56) ALDH1A1MAOBL3MBTL1CYP1A2CYP1A1
SCHEMBL6155824 0.87 TUBB1 (0.62) ALDH1A1MAOBCYP1A2CYP1A1CYP1B1
SCHEMBL3209556 0.87 ALDH1A1 (0.69) ALDH1A1MAOBL3MBTL1CYP1A2CYP1A1
SCHEMBL3334328 0.86 ALDH1A1 (0.59) ALDH1A1MAOBL3MBTL1CYP1A2CYP1A1
SCHEMBL5143351 0.85 ALDH1A1 (0.67) ALDH1A1MAOBL3MBTL1CYP1A2CYP1A1
SCHEMBL702232 0.85 ALDH1A1 (0.71) ALDH1A1MAOBL3MBTL1CYP1A2CYP1A1
SCHEMBL22090594 0.84 HDAC8 (0.53) ALDH1A1L3MBTL1CYP1A2TUBB1TDP1
SCHEMBL20535326 0.83 PRKDC (0.47) ALDH1A1MAOBL3MBTL1CYP1A2TUBB1
SCHEMBL1566049 0.83 ALDH1A1 (0.69) ALDH1A1MAOBL3MBTL1CYP1A2CYP1A1
SCHEMBL14539352 0.83 ALDH1A1 (0.69) ALDH1A1MAOBL3MBTL1CYP1A2CYP1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119707903-A Isopentenyl flavonoid compound and preparation method and application thereof 中山大学 2025-03-28 CN claimed
EP-4725942-A1 COMPOUNDS ACTIVE ON CYCLIN D1 PATHWAY AND THEIR USE Sibylla Biotech S.p.A. (IT) 2026-04-15 EP disclosed
CN-119707903-A Isopentenyl flavonoid compound and preparation method and application thereof 中山大学 2025-03-28 CN disclosed
CN-119504685-A Benzopyran flavonoid compound, preparation method and application thereof, and pharmaceutical preparation 南开大学 2025-02-25 CN disclosed
CN-111184866-B Combination treatment of bacterial infections 香港中文大学 2023-12-19 CN disclosed
US-11690810-B2 Combination treatment of bacterial infection THE CHINESE UNIVERSITY OF HONG KONG (CN) 2023-07-04 US disclosed
CN-111184866-A Combination therapy for bacterial infections 香港中文大学 2020-05-22 CN disclosed
US-20200155641-A1 COMBINATION TREATMENT OF BACTERIAL INFECTION THE CHINESE UNIVERSITY OF HONG KONG (CN) 2020-05-21 US disclosed
US-7553867-B2 Furan or thiophene derivative and medicinal use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-30 US disclosed
US-20060100261-A1 Furan or thiopene derivative and medicinal use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED INTELLECTUAL PROPERTY DEPARTMENT (JP) 2006-05-11 US disclosed
EP-1535915-A1 FURAN OR THIOPHENE DERIVATIVE AND MEDICINAL USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2005-06-01 EP 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 (3 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-20200155641-A1 COMBINATION TREATMENT OF BACTERIAL INFECTION PGC, NRDC, PYCARD ALDH1A1 3345/4885MAOB 1068/4885L3MBTL1 2147/4885
US-11690810-B2 Combination treatment of bacterial infection PGC, NRDC, PYCARD ALDH1A1 3345/4885MAOB 1068/4885L3MBTL1 2147/4885
US-20060100261-A1 Furan or thiopene derivative and medicinal use thereof TXN2, CYP11B2, CYP11B1 ALDH1A1 1096/4885MAOB 2227/4885L3MBTL1 1515/4885

“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.