SCHEMBL2003333

SCHEMBL2003333

Cc1[nH]c2ccc(O)cc2c1CC(=O)O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.75
GAA P10253 6/20 0.75
MAPT P10636 6/20 0.75
ALDH1A1 P00352 5/20 0.75
MEN1 O00255 4/20 0.75
KMT2A Q03164 4/20 0.75
AKR1C2 P52895 1/20 0.68
CASP1 P29466 1/20 0.65
CASP7 P55210 1/20 0.65
HSD17B10 Q99714 3/20 0.61
CYP2C9 P11712 2/20 0.61
CYP1A2 P05177 2/20 0.61
CYP3A4 P08684 2/20 0.61
CYP2C19 P33261 2/20 0.61
CYP2D6 P10635 1/20 0.61
HTR1D P28221 1/20 0.61
MAPK1 P28482 1/20 0.61
HTR7 P34969 1/20 0.61
HTR3A P46098 1/20 0.61
HTR6 P50406 1/20 0.61

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
Chlorobenzene SCHEMBL5797046 0.91 GAA (0.63) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL2004066 0.88 KDM4E (0.65) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL27380744 0.86 HTR7 (0.64) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL30854920 0.86 KDM4E (1.00) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL6102581 0.86 KDM4E (1.00) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL852745 0.85 HSD17B10 (0.67) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL11788979 0.84 HTR7 (0.65) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL6825323 0.84 SPR (0.60) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL1757962 0.83 KDM4E (0.73) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL3408821 0.83 KDM4E (0.73) KDM4EGAAMAPTALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481587-B2 Substituted 2-(5-hydroxy-2-methyl-1H-indole-3-yl)acetic acids and ethers thereof and the use of same to treat viral diseases IVASHCHENKO ANDREY ALEXANDROVICH (RU) 2013-07-09 US claimed
US-20110230524-A1 SUBSTITUTED 2-(5-HYDROXY-2-METHYL-1H-INDOLE-3-YL)ACETIC ACIDS AND ETHERS THEREOF AND THE USE OF SAME TO TREAT VIRAL DISEASES ALLA CHEM, LLC. 2011-09-22 US claimed
EP-1628532-A2 METHODS FOR THE PROTECTION OF MEMORY AND COGNITION Microbia, Inc. (US) 2006-03-01 EP claimed
US-20050004104-A1 Methods for the protection of memory and cognition IRONWOOD PHARMACEUTICALS, INC. 2005-01-06 US claimed
WO-2004108085-A2 METHODS FOR THE PROTECTION OF MEMORY AND COGNITION MICROBIA, INC. (US) 2004-12-16 WO claimed
EP-3954679-A2 AMIDE COMPOUNDS FOR THE TREATMENT OF HIV INFECTIONS Gilead Sciences, Inc. (US) 2022-02-16 EP disclosed
EP-3409667-B1 AMIDE COMPOUNDS FOR THE TREATMENT OF HIV INFECTIONS GILEAD SCIENCES INC (US) 2021-07-21 EP disclosed
US-20210009555-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2021-01-14 US disclosed
EP-3409667-A1 AMIDE COMPOUNDS FOR THE TREATMENT OF HIV INFECTIONS Gilead Sciences, Inc. (US) 2018-12-05 EP disclosed
US-20180273508-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2018-09-27 US disclosed
EP-2961742-B1 AMIDE COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES INC (US) 2018-08-01 EP disclosed
CN-105705500-A Amide compounds for the treatment of HIV 吉利德科学公司 2016-06-22 CN disclosed
WO-2007022501-A2 USEFUL INDOLE COMPOUNDS MICROBIA, INC. (US) 2007-02-22 WO disclosed
EP-1628532-A2 METHODS FOR THE PROTECTION OF MEMORY AND COGNITION Microbia, Inc. (US) 2006-03-01 EP disclosed
US-20050004104-A1 Methods for the protection of memory and cognition IRONWOOD PHARMACEUTICALS, INC. 2005-01-06 US disclosed
WO-2004108085-A2 METHODS FOR THE PROTECTION OF MEMORY AND COGNITION MICROBIA, INC. (US) 2004-12-16 WO disclosed
US-5420289-A ANTIINFLAMMATORY AGENTS, ANTIALLERGENS AND CYTOPROTECTIVE AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1995-05-30 US disclosed
US-5229516-A Antiinflammatory agents, antiallergens and cytoprotective agents AMERICAN HOME PRODUCTS CORPORATION (US) 1993-07-20 US disclosed
EP-0502106-A1 SUBSTITUTED INDOLE-, INDENE-, PYRANOINDOLE- AND TETRAHYDROCARBAZOLE- ALKANOIC ACID DERIVATIVES AS INHIBITORS OF PLA2 AND LIPOXYGENASE AMERICAN HOME PRODUCTS CORPORATION (US) 1992-09-09 EP disclosed
WO-1991006537-A2 SUBSTITUTED INDOLE-, INDENE-, PYRANOINDOLE- AND TETRAHYDROCARBAZOLE- ALKANOIC ACID DERIVATIVES AS INHIBITORS OF PLA2 AND LIPOXYGENASE AMERICAN HOME PRODUCTS CORPORATION (US) 1991-05-16 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 (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-20180273508-A1 THERAPEUTIC COMPOUNDS HAVCR2, SARS1, RPL35 KDM4E 4453/4885GAA 17/4885MAPT 1547/4885
US-20210009555-A1 THERAPEUTIC COMPOUNDS HAVCR2, SARS1, RPL35 KDM4E 4453/4885GAA 17/4885MAPT 1547/4885
US-20050004104-A1 Methods for the protection of memory and cognition PTGES2, PTGS2, PTGS1 KDM4E 2737/4885GAA 935/4885MAPT 30/4885
US-20110230524-A1 SUBSTITUTED 2-(5-HYDROXY-2-METHYL-1H-INDOLE-3-YL)ACETIC ACIDS AND ETHERS THEREOF AND THE USE OF SAME TO TREAT VIRAL DISEASES IDO1, TPH1, FOXM1 KDM4E 1072/4885GAA 3206/4885MAPT 4599/4885

“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.