Coumarin

Coumarin

SCHEMBL314829

CC(=O)O.O=c1ccc2ccccc2o1

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Coumarin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 13/20 0.77
CA12 O43570 12/20 0.77
CA1 P00915 4/20 0.77
TDP1 Q9NUW8 3/20 0.77
CA3 P07451 3/20 0.77
CA4 P22748 3/20 0.77
CA5A P35218 3/20 0.77
CA7 P43166 3/20 0.77
CA14 Q9ULX7 3/20 0.77
CA5B Q9Y2D0 3/20 0.77
MCL1 Q07820 3/20 0.77
CA2 P00918 2/20 0.77
CA6 P23280 2/20 0.77
LMNA P02545 1/20 0.77
SOST Q9BQB4 1/20 0.77
KDM4E B2RXH2 5/20 0.51
POLB P06746 2/20 0.51
GLA P06280 2/20 0.51
GAA P10253 2/20 0.51
PGR P06401 2/20 0.51

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
Coumarin SCHEMBL28058644 0.95 CA9 (0.69) CA9CA12CA1TDP1CA3
Coumarin SCHEMBL27598031 0.94 CA9 (0.80) CA9CA12CA1TDP1CA3
Coumarin SCHEMBL1090505 0.92 CA12 (0.83) CA9CA12CA1TDP1CA3
Coumarin SCHEMBL25431834 0.92 CA12 (0.91) CA9CA12CA1TDP1CA3
Coumarin SCHEMBL11101317 0.90 CA12 (0.87) CA9CA12CA1TDP1CA3
Coumarin SCHEMBL19183240 0.90 CA12 (0.95) CA9CA12CA1TDP1CA3
SCHEMBL7358531 0.90 CA12 (0.95) CA9CA12CA1TDP1CA3
Coumarin SCHEMBL27373119 0.90 CA9 (0.67) CA9CA12CA1TDP1CA3
Coumarin SCHEMBL27601322 0.89 CA9 (0.71) CA9CA12CA1TDP1CA3
Coumarin SCHEMBL29078087 0.89 CA12 (0.77) CA9CA12CA1TDP1CA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117789993-B Establishment and application of gastric cancer prediction model based on tongue fur metabolite 浙江省肿瘤医院 2024-06-11 CN claimed
CN-117789993-A Establishment and application of gastric cancer prediction model based on tongue fur metabolite 浙江省肿瘤医院 2024-03-29 CN claimed
CN-110199019-A Analysis of Macromolecules Using Nucleic Acid Encoding ENCODIA有限公司 2019-09-03 CN claimed
CN-108129388-A A kind of rhodamine double pyrazole acetic acid esters organic laser material and its application 深圳市佶达德科技有限公司 2018-06-08 CN claimed
CN-108047211-A A kind of double pyrazole acetic acid coumarin derivative laser material and its application 深圳市佶达德科技有限公司 2018-05-18 CN claimed
US-8735178-B2 Withanolides, probes and binding targets and methods of use thereof UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2014-05-27 US claimed
CN-1872054-B Drop pills of coumarin acetic acid, and preparation method TIANJIN TASLY PHARMACEUTICAL 2010-11-03 CN claimed
US-20080207574-A1 WITHANOLIDES, PROBES AND BINDING TARGETS AND METHODS OF USE THEREOF KENTUCKY RESEARCH FOUNDATION 2008-08-28 US claimed
CN-1872054-A Drop pills of coumarin acetic acid, and preparation method TIANSHILI PHARM CO LTD (CN) 2006-12-06 CN claimed
CN-1863805-A Disulfide, sulfide, sulfoxide and sulfone derivatives of cyclic sugars and uses thereof LACER SA (ES) 2006-11-15 CN claimed
CN-1493281-A Coumarin acetate drip pill and its preparation method 南昌弘益科技有限公司 2004-05-05 CN claimed
EP-0975803-A4 METHOD FOR ASSESSING PROSTATE CANCER ALBANY MEDICAL COLLEGE (US) 2002-01-16 EP claimed
EP-0975803-A1 METHOD FOR ASSESSING PROSTATE CANCER ALBANY MEDICAL COLLEGE (US) 2000-02-02 EP claimed
WO-1998045479-A1 METHOD FOR ASSESSING PROSTATE CANCER ALBANY MEDICAL COLLEGE (US) 1998-10-15 WO claimed
US-20250314643-A1 FLUORESCENT COMPLEXES COMPRISING TWO RHODAMINE DERIVATIVES AND A NUCLEIC ACID MOLECULE CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2025-10-09 US disclosed
CN-115851634-B Application of human CYP2C9 recombinase in denitration of nitrocellulose 南京理工大学 2025-02-14 CN disclosed
CN-114555585-B HPK1 inhibitors and uses thereof 锐格药业公司 2025-02-11 CN disclosed
EP-0277139-B1 7-AMINO-4-METHYL-COUMARIN-3-CARBOXYALKYL DERIVATIVES AND FLUORESCENT CONJUGATES THEREOF BIOCARB AB (SE) 1990-08-08 EP disclosed
EP-0277139-A1 7-AMINO-4-METHYL-COUMARIN-3-CARBOXYALKYL DERIVATIVES AND FLUORESCENT CONJUGATES THEREOF. BIOCARB AB (SE) 1988-08-10 EP disclosed
WO-1987003589-A1 7-AMINO-4-METHYL-COUMARIN-3-CABOXYALKYL DERIVATES AND FLUORESCENT CONJUGATES THEREOF BIOCARB AB (SE) 1987-06-18 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 (1 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-20080207574-A1 WITHANOLIDES, PROBES AND BINDING TARGETS AND METHODS OF USE THEREOF VIM, HASPIN, FABP3 CA9 3558/4885CA12 3288/4885CA1 4752/4885

“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.