Ayapin

Ayapin

SCHEMBL6694210

O=c1ccc2cc3c(cc2o1)OCO3

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.57
▸ ALDH1A1 P00352 9/20 0.57
▸ HPGD P15428 7/20 0.57
▸ HSD17B10 Q99714 6/20 0.57
▸ GAA P10253 6/20 0.53
▸ ACHE P22303 5/20 0.53
▸ MCL1 Q07820 4/20 0.53
▸ CA12 O43570 4/20 0.53
▸ CA9 Q16790 4/20 0.53
▸ CYP3A4 P08684 2/20 0.53
▸ GLA P06280 2/20 0.53
▸ AKR1B1 P15121 2/20 0.53
▸ CASP1 P29466 2/20 0.53
▸ CASP7 P55210 2/20 0.53
▸ ERAP1 Q9NZ08 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ BCHE P06276 1/20 0.53

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
Ayapin SCHEMBL30171405 1.00 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL6843275 0.89 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL28994323 0.82 ALDH1A1 (0.59) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL12075314 0.77 KDM4E (0.65) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL3277376 0.75 GAA (0.49) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL6664851 0.75 ALDH1A1 (0.63) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL6664850 0.75 ALDH1A1 (0.63) KDM4EALDH1A1HPGDHSD17B10GAA
Dihydro-Obliquin SCHEMBL12062091 0.74 ALDH1A1 (1.00) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL4740620 0.74 GAA (0.48) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL15842745 0.74 CA9 (0.59) KDM4EALDH1A1HPGDHSD17B10GAA

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12215332-B2 Method of increasing resistance against soybean rust in transgenic plants by increasing the scoparone BASF PLANT SCIENCE COMPANY GMBH (DE) 2025-02-04 — — US disclosed
EP-4479540-A1 COUMARIN SYNTHESIS AND USES THEREOF BASF SE (DE) 2024-12-25 — — EP disclosed
US-20240384288-A1 COUMARIN TRANSPORTERS AND USES THEREOF BASF PLANT SCIENCE COMPANY GMBH (DE) 2024-11-21 — — US disclosed
CN-118715324-A Coumarin synthesis and application thereof 巴斯夫欧洲公司 2024-09-27 — — CN disclosed
EP-4405378-A1 COUMARIN TRANSPORTERS AND USES THEREOF BASF Plant Science Company GmbH (DE) 2024-07-31 — — EP disclosed
CN-117740961-A Compound analysis method of liquorice and liquorice probiotics fermentation preparation 北京中医药大学 2024-03-22 — — CN disclosed
WO-2023156270-A1 COUMARIN SYNTHESIS AND USES THEREOF BASF SE (DE) 2023-08-24 — — WO disclosed
WO-2023150072-A1 COMPOSITIONS AND METHODS FOR THE PRESERVATION OF PLANT MATTER SINCLAIR DAVID A (US) 2023-08-10 — — WO disclosed
WO-2023041649-A1 COUMARIN TRANSPORTERS AND USES THEREOF BASF PLANT SCIENCE COMPANY GMBH (DE) 2023-03-23 — — WO disclosed
US-20230022475-A1 METHOD OF INCREASING RESISTANCE AGAINST SOYBEAN RUST IN TRANSGENIC PLANTS BY INCREASING THE SCOPARONE BASF PLANT SCIENCE COMPANY GMBH (DE) 2023-01-26 — — US disclosed
US-20040049056-A1 Process for preparation of esculetin compounds, esculetin compounds and intermediates thereof, and use of both KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 2004-03-11 — — US disclosed
EP-1357118-A1 PROCESS FOR PREPARATION OF ESCULETIN COMPOUNDS, ESCULETIN COMPOUNDS AND INTERMEDIATES THEREOF, AND USE OF BOTH Kureha Chemical Industry Co., Ltd. (JP) 2003-10-29 — — EP disclosed
JP-2003267964-A METHOD FOR PRODUCING 6,7-DIHYDROXYCOUMARIN AND ITS INTERMEDIATE UBE IND LTD 2003-09-25 — — JP disclosed
JP-2003238553-A 3-CHLORO-6,7-DIHYDROXYCOUMARIN AND METHOD FOR PRODUCING THE SAME UBE IND LTD 2003-08-27 — — JP disclosed
EP-0850221-B1 META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS SEARLE & CO (US) 2001-07-18 — — EP disclosed
US-6028223-A AN INTEGRIN ANTAGONISTS TREATING BONE DISORDER, PERIODONTAL DISEASE, OSTEOPOROSIS, HUMORAL HYPERCALCEMIA OF MALIGNANCY, PAGET'S DISEASE, TUMOR ANGIOGENESIS, DIABETIC RETINOPATHY, ARTHRITIS, SMOOTH MUSCLE CELL MIGRATION AND RESTENOSIS G. D. SEARLE & CO. (US) 2000-02-22 — — US disclosed
US-5958782-A FLUORESCENT IONOPHORIC COMPOUND IS DISCLOSED THAT INCLUDES A COMPLEXING MOIETY, SUCH AS A CRYPTAND OR CROWN-ETHER PORTION, AND A FLUORESCING MOIETY SUCH AS A COUMARIN PORTION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-09-28 — — US disclosed
EP-0861843-A2 Fluorescent ionophoric compounds with a cryptand/crown-ether portion and a coumarin portion, their preparation and their use for measuring metal cation concentrations MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-09-02 — — EP disclosed
EP-0850221-A1 META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS G.D. SEARLE & CO. (US) 1998-07-01 — — EP disclosed
WO-1997008145-A1 META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS G.D. SEARLE & CO. (US) 1997-03-06 — — 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 (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-20040049056-A1 Process for preparation of esculetin compounds, esculetin compounds and intermediates thereof, and use of both SUCLG1, SALL4, HSD17B14 KDM4E 1966/4885ALDH1A1 71/4885HPGD 886/4885
US-12215332-B2 Method of increasing resistance against soybean rust in transgenic plants by increasing the scoparone TPST2, SOAT2, ACAT2 KDM4E 3604/4885ALDH1A1 4118/4885HPGD 3459/4885

“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.

Send feedback