SCHEMBL54695

SCHEMBL54695

COc1ccc(C(=O)O)o1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.54
TDP1 Q9NUW8 3/20 0.54
MEN1 O00255 3/20 0.54
ALDH1A1 P00352 9/20 0.51
HPGD P15428 6/20 0.51
KDM4E B2RXH2 2/20 0.51
HSD17B10 Q99714 1/20 0.51
MAPT P10636 3/20 0.47
POLB P06746 1/20 0.42
NPSR1 Q6W5P4 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
SCHEMBL1603168 0.83 LMNA (0.42) KMT2ATDP1MEN1ALDH1A1HPGD
SCHEMBL19442049 0.81 HTT (0.58) KMT2AMEN1ALDH1A1HPGDKDM4E
SCHEMBL7070609 0.81 TDP1 (0.38) KMT2ATDP1MEN1ALDH1A1HPGD
SCHEMBL6229622 0.79 TDP1 (0.51) KMT2ATDP1MEN1ALDH1A1HPGD
SCHEMBL7138575 0.79 ALDH1A1 (0.65) KMT2ATDP1MEN1ALDH1A1HPGD
SCHEMBL18407151 0.78 TDP1 (0.50) KMT2ATDP1MEN1ALDH1A1HPGD
SCHEMBL4892995 0.78 TDP1 (0.68) KMT2ATDP1MEN1ALDH1A1HPGD
Hydrochloric Acid SCHEMBL31462928 0.77 ALDH1A1 (0.63) KMT2ATDP1MEN1ALDH1A1HPGD
SCHEMBL38726 0.75 TDP1 (0.61) KMT2ATDP1MEN1ALDH1A1HPGD
SCHEMBL11904537 0.75 TDP1 (0.61) KMT2ATDP1MEN1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7692005-B2 Kinase inhibitors ALLERGAN, INC. (US) 2010-04-06 US claimed
EP-1902025-A1 KINASE INHIBITORS Allergan, Inc. (US) 2008-03-26 EP claimed
US-7297168-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2007-11-20 US claimed
US-20070032478-A1 Kinase Inhibitors ALLERGAN, INC. 2007-02-08 US claimed
WO-2007008895-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2007-01-18 WO claimed
US-20050198745-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER & GAMBLE COMPANY, THE 2005-09-15 US claimed
CN-114773298-B Preparation method of 2, 5-disubstituted furan compound 中国科学院宁波材料技术与工程研究所 2024-09-20 CN disclosed
EP-4251621-A1 AROMATIC SPIRO RING AMIDE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION F. Hoffmann-La Roche AG (CH) 2023-10-04 EP disclosed
US-20230286969-A1 AROMATIC SPIRO RING AMIDE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN-LA ROCHE INC. (US) 2023-09-14 US disclosed
CN-116390920-A Aromatic spirocyclic amide derivatives for the treatment and prevention of hepatitis b virus infection 豪夫迈·罗氏有限公司 2023-07-04 CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
CN-114773299-A Preparation method of 2, 5-disubstituted furan compound 中国科学院宁波材料技术与工程研究所 2022-07-22 CN disclosed
CN-114773298-A Preparation method of 2, 5-disubstituted furan compound 中国科学院宁波材料技术与工程研究所 2022-07-22 CN disclosed
US-20050198745-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER & GAMBLE COMPANY, THE 2005-09-15 US disclosed
WO-2005074875-A2 KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING THEM, AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2005-08-18 WO disclosed
US-20040242591-A1 Oxazolidinone derivatives as pontential antimicrobials RANBAXY LABORATORIES LIMITED (IN) 2004-12-02 US disclosed
EP-1409464-A1 OXAZOLIDINONE DERIVATIVES AS POTENTIAL ANTIMICROBIALS RANBAXY LABORATORIES, LTD. (IN) 2004-04-21 EP disclosed
WO-2003008389-A1 OXAZOLIDINONE DERIVATIVES AS POTENTIAL ANTIMICROBIALS RANBAXY LABORATORIES LIMITED (IN) 2003-01-30 WO disclosed
US-4634783-A ENZYME INHIBITORS, ANTICOMPLEMENT AGENT TORII & CO. LTD. (JP) 1987-01-06 US disclosed
US-4282246-A Antidiabetic furancarboxylic and thiphenecarboxylic acids PFIZER INC. (US) 1981-08-04 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 (4 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-20040242591-A1 Oxazolidinone derivatives as pontential antimicrobials PDK4, OXA1L, PPARD KMT2A 4151/4885TDP1 2252/4885MEN1 2846/4885
US-20230286969-A1 AROMATIC SPIRO RING AMIDE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HAVCR2, NR1H4, SLC10A1 KMT2A 2189/4885TDP1 4377/4885MEN1 2062/4885
US-20050198745-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof KRT18, CKMT1A; CKMT1B, CYB5R3 KMT2A 1179/4885TDP1 3239/4885MEN1 4871/4885
US-20070032478-A1 Kinase Inhibitors ABL1, LCK, ERBB2 KMT2A 1569/4885TDP1 1059/4885MEN1 2293/4885

“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.