SCHEMBL1815150

SCHEMBL1815150

O=c1ccc2c(o1)C=CCO2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 7/20 0.43
CYP1B1 Q16678 6/20 0.43
CA1 P00915 2/20 0.41
CA9 Q16790 2/20 0.41
CYP1A1 P04798 6/20 0.40
CYP2B6 P20813 2/20 0.36
CA12 O43570 1/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 1/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
MCL1 Q07820 1/20 0.32
SOST Q9BQB4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
STS P08842 1/20 0.32

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
SCHEMBL29207958 0.73 CYP1A2 (0.58) CYP1A2CYP1B1CA9CYP1A1CYP2B6
SCHEMBL4614504 0.68
SCHEMBL9464450 0.67 KDM4E (0.54) CYP1A2CA1CA9CYP2B6CA12
SCHEMBL12477741 0.65 CA1 (0.33) CYP1A2CYP1B1CA1CA9CYP1A1
SCHEMBL8487842 0.64 CA1 (0.32) CA1CA9CA12CA2LMNA
SCHEMBL10712969 0.63 CA1 (0.32) CYP1A2CYP1B1CA1CA9STS
SCHEMBL277261 0.60 CYP2B6 (0.46) CYP1A2CYP1B1CA1CA9CYP1A1
SCHEMBL7485477 0.60 PKM (0.48) CYP1A2CYP1B1CA1CA9CYP1A1
Furan-2(5H)-One SCHEMBL25302 0.60
SCHEMBL2781166 0.58 CA1 (0.44) CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110224170-A1 Pyranopyranone derivatives as antimicrobial agents BASF SE (DE) 2011-09-15 US claimed
WO-2011107411-A1 PYRANOPYRANONE DERIVATIVES AS ANTIMICROBIAL AGENTS BASF SE (DE) 2011-09-09 WO claimed
JP-10330268-A None JP disclosed
CN-115414480-A Dianhydrogalactitol in combination with radiation for treatment of non-small cell lung cancer and glioblastoma multiforme 德玛医药 2022-12-02 CN disclosed
EP-3115052-B1 D-PSICOSE FOR USE IN THE TREATMENT OF ARTERIOSCLEROSIS MATSUTANI KAGAKU KOGYO KK (JP) 2019-08-21 EP disclosed
EP-3175858-A1 THERAPEUTIC USE OF D-ALLOSE FOR THE TREATMENT OF LIVER CANCER OR SKIN CANCER Matsutani Chemical Industry Co., Ltd. (JP) 2017-06-07 EP disclosed
EP-3115052-A1 D-PSICOSE FOR USE IN THE TREATMENT OF ARTERIOSCLEROSIS Matsutani Chemical Industry Co., Ltd. (JP) 2017-01-11 EP disclosed
US-8420606-B2 Method of utilizing physiological activity of rare saccharide and composition containing rare saccharide FUSHIMI PHARMACEUTICAL CO., LTD. (JP) 2013-04-16 US disclosed
WO-2011131474-A2 SKIN-GENTLE DEODORANTS AND ANTIPERSPIRANTS HENKEL AG & CO. KGAA (DE) 2011-10-27 WO disclosed
EP-2370177-A2 NOVEL COSMETIC COMPOSITIONS HAVING HAIR GROWTH INHIBITING EFFECT Henkel AG & Co. KGaA (DE) 2011-10-05 EP disclosed
EP-2370050-A2 NOVEL DEODORANTS AND ANTIPERSPIRANTS HAVING HAIR GROWTH INHIBITING EFFECT Henkel AG & Co. KGaA (DE) 2011-10-05 EP disclosed
WO-2009007257-A2 ADVANCED GLYCATION END PRODUCTS AS ACTIVE INGREDIENTS HENKEL AG & CO. KGAA (DE) 2009-01-15 WO disclosed
US-20050245459-A1 Method of utilizing physiological activity of rare saccharide and composition containing rare saccharide Fushimi Pharmaceutical Co. Ltd. (JP) 2005-11-03 US disclosed
EP-1538200-A1 METHOD OF UTILIZING PHYSIOLOGICAL ACTIVITY OF RARE SACCHARIDE AND COMPOSITIONS CONTAINING RARE SACCHARIDE Fushimi Pharmaceutical Company, Limited (JP) 2005-06-08 EP disclosed
JP-H10330268-A AGENT FOR INHIBITING SYNTHESIS OF PYRANOPYRANONE COMPOUND-CONTAINING HSP47 KUREHA CHEM IND CO LTD 1998-12-15 JP disclosed
US-4198426-A 2-Substituted-3-methyl-γ-pyrone tricyclic derivatives AYERST MCKENNA & HARRISON LTD. (CA) 1980-04-15 US disclosed
US-4189490-A 2-Substituted-3-methyl-γ-pyrone tricyclic derivatives AYERST MCKENNA & HARRISON LIMITED (CA) 1980-02-19 US disclosed
US-4177284-A 2-Substituted-3-methyl-γ-pyrone tricvclic derivatives and process therefor AYERST MCKENNA & HARRISON LTD. (CA) 1979-12-04 US disclosed
US-4105778-A ANTIALLERGENS, BACTERICIDES, FUNGICIDES AYERST, MCKENNA & HARRISON, LTD. (CA) 1978-08-08 US disclosed
US-4060619-A ANTIALLERGY, MICROBIOCIDE AYERST MCKENNA AND HARRISON LTD. (CA) 1977-11-29 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 (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-20110224170-A1 Pyranopyranone derivatives as antimicrobial agents NR1H2, CBR3, NR1H3 CYP1A2 976/4885CYP1B1 706/4885CA1 3872/4885

“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.