SCHEMBL765967

SCHEMBL765967

O=Cc1cc2c(cc1O)OCO2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ ALDH1A1 P00352 3/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ ERN1 O75460 6/20 0.43
▸ CYP3A4 P08684 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.40
▸ TRIM24 O15164 1/20 0.40
▸ TRIM33 Q9UPN9 1/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PIK3CD O00329 1/20 0.38
▸ PIK3CA P42336 1/20 0.38
▸ PIK3CB P42338 1/20 0.38
▸ PIK3CG P48736 1/20 0.38
▸ PRKDC P78527 1/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ MEN1 O00255 1/20 0.36

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
SCHEMBL30634677 1.00 LMNA (0.55) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL1317358 0.88 ERN1 (0.49) LMNAHPGDERN1HSP90AA1TRIM24
SCHEMBL14070022 0.84 LMNA (0.64) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL18138421 0.79 CYP3A4 (0.42) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL12834536 0.77 ERN1 (0.63) ALDH1A1TDP1HSD17B10ERN1
SCHEMBL2268770 0.77 CYP3A4 (0.56) ALDH1A1CYP3A4MAPTKMT2AMAPK1
SCHEMBL31123847 0.76 HPGD (0.56) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL14284010 0.76 CYP3A4 (0.50) LMNAHPGDALDH1A1ERN1CYP3A4
SCHEMBL1128702 0.76 HPGD (0.56) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL23727631 0.76 KDM4E (0.51) LMNAHPGDALDH1A1TDP1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2250882-A — — None — — JP disclosed
CN-112996566-B Chroman-4-one derivatives for the treatment and prevention of hepatitis B virus infection 豪夫迈·罗氏有限公司 2023-11-03 — — CN disclosed
US-11664093-B2 Extrapolative prediction of enantioselectivity enabled by computer-driven workflow, new molecular representations and machine learning THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2023-05-30 — — US disclosed
US-20220388972-A1 CHROMAN-4-ONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN-LA ROCHE INC. (US) 2022-12-08 — — US disclosed
WO-2022135136-A1 TUBERCULATIN ANALOGS AS ANTIVIRAL AGENTS HONG KONG BAPTIST UNIVERSITY (CN) 2022-06-30 — — WO disclosed
US-11208419-B2 Phenylbenzofuran compound, preparation method therefor, composition containing the same and medical application thereof GUANGXI BOTANICAL GARDEN OF MEDICINAL PLANTS (CN) 2021-12-28 — — US disclosed
EP-3894004-A1 CHROMAN-4-ONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION F. Hoffmann-La Roche AG (CH) 2021-10-20 — — EP disclosed
US-20210198270-A1 PHENYLBENZOFURAN COMPOUND, PREPARATION METHOD THEREFOR, COMPOSITION CONTAINING THE SAME AND MEDICAL APPLICATION THEREOF GUANGXI BOTANICAL GARDEN OF MEDICINAL PLANTS (CN) 2021-07-01 — — US disclosed
CN-112996566-A Chroman-4-one derivatives for the treatment and prevention of hepatitis B virus infection 豪夫迈·罗氏有限公司 2021-06-18 — — CN disclosed
WO-2020120642-A1 CHROMAN-4-ONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION F. HOFFMANN-LA ROCHE AG (CH) 2020-06-18 — — WO disclosed
US-20050148627-A1 Benzopyran compounds for use in the treatment and prevention of inflammation related conditions CARTER JEFFERY (US) 2005-07-07 — — US disclosed
US-20050148777-A1 Benzopyran compounds useful for treating inflammatory conditions CARTER JEFFERY (US) 2005-07-07 — — US disclosed
WO-2004087687-A1 CHROMENE DERIVATIVES AS ANTI-INFLAMMATORY AGENTS PHARMACIA CORPORATION (US) 2004-10-14 — — WO 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
EP-0769015-B1 PHOSPHONIC ACID COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-03-14 — — EP disclosed
US-5716944-A USEFUL AS PROPHYLACTIC AND THERAPEUTIC AGENTS OF VARIOUS METABOLIC BONE DISEASES SUCH AS OSTEOPOROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-02-10 — — US disclosed
EP-0769015-A1 PHOSPHONIC ACID COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-04-23 — — EP disclosed
WO-1996001267-A1 PHOSPHONIC ACID COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-01-18 — — WO disclosed
JP-H02250882-A NEW FLUORESCENT LABELING AGENT DOUJIN KAGAKU KENKYUSHO:KK 1990-10-08 — — JP 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 (6 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-20050148777-A1 Benzopyran compounds useful for treating inflammatory conditions PTGES2, PTGER2, PTGS2 LMNA 3346/4885HPGD 101/4885ALDH1A1 560/4885
US-20040049056-A1 Process for preparation of esculetin compounds, esculetin compounds and intermediates thereof, and use of both SUCLG1, SALL4, HSD17B14 LMNA 2746/4885HPGD 886/4885ALDH1A1 71/4885
US-11208419-B2 Phenylbenzofuran compound, preparation method therefor, composition containing the same and medical application thereof WEE1, WEE2, WASF2 LMNA 1344/4885HPGD 1370/4885ALDH1A1 3452/4885
US-20210198270-A1 PHENYLBENZOFURAN COMPOUND, PREPARATION METHOD THEREFOR, COMPOSITION CONTAINING THE SAME AND MEDICAL APPLICATION THEREOF WEE1, WEE2, WASF2 LMNA 1344/4885HPGD 1370/4885ALDH1A1 3452/4885
US-20220388972-A1 CHROMAN-4-ONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HAVCR2, CYP4B1, CYP7A1 LMNA 724/4885HPGD 1978/4885ALDH1A1 920/4885
US-20050148627-A1 Benzopyran compounds for use in the treatment and prevention of inflammation related conditions PTGES2, PTGER2, PTGES LMNA 2102/4885HPGD 152/4885ALDH1A1 422/4885

“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.

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