SCHEMBL7089376

SCHEMBL7089376

COC(COc1ccccc1)OC

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
MAOA P21397 1/20 0.52
PTGS1 P23219 1/20 0.52
SCN4A P35499 2/20 0.50
KCNA3 P22001 1/20 0.46
MTNR1A P48039 3/20 0.46
MTNR1B P49286 3/20 0.46
CYP2D6 P10635 2/20 0.46
ADRB2 P07550 1/20 0.46
ADRB1 P08588 1/20 0.46
ADRB3 P13945 1/20 0.46
CA4 P22748 1/20 0.44
LTA4H P09960 1/20 0.43
HTR1D P28221 1/20 0.42
HTR1B P28222 1/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL7816346 0.92 LTA4H (0.57) LMNAMAOAPTGS1SCN4ALTA4H
SCHEMBL7046801 0.88 KDM1A (0.48) LMNAMAOA
SCHEMBL17171595 0.82 LMNA (0.57) LMNAMAOAPTGS1SCN4AKCNA3
SCHEMBL7931690 0.82 CYP2C9 (0.60)
SCHEMBL8202784 0.81 KCNA3 (0.57) LMNAKCNA3LTA4HHTR1DHTR1B
SCHEMBL7929604 0.81 KCNA3 (0.52) LMNAKCNA3LTA4HHTR1DHTR1B
SCHEMBL17996498 0.80 TSHR (0.47) LMNACYP2D6L3MBTL1
SCHEMBL10013740 0.80 LMNA (0.61) LMNAMAOAPTGS1SCN4AKCNA3
SCHEMBL10860743 0.78 LMNA (0.53) LMNAMAOAPTGS1SCN4AKCNA3
SCHEMBL16166837 0.78 LMNA (0.53) LMNAMAOAPTGS1SCN4AKCNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117143169-A Synthesis and application of ginsenoside compound K derivative 港大科桥有限公司 2023-12-01 CN disclosed
CN-109206387-A Reactive liquid crystalline original, liquid-crystal composition and the liquid crystal display device comprising it 东进世美肯株式会社 2019-01-15 CN disclosed
US-20110294792-A1 PURINE DERIVATIVES AS KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2011-12-01 US disclosed
US-20110294792-A1 PURINE DERIVATIVES AS KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2011-12-01 US disclosed
US-8058425-B2 Purine derivatives as kinase inhibitors ELI LILLY AND COMPANY (US) 2011-11-15 US disclosed
US-8058425-B2 Purine derivatives as kinase inhibitors ELI LILLY AND COMPANY (US) 2011-11-15 US disclosed
US-8022065-B2 Purine derivatives as kinase inhibitors ELI LILLY AND COMPANY (US) 2011-09-20 US disclosed
US-20110207721-A1 PURINE DERIVATIVES AS KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2011-08-25 US disclosed
US-20110207721-A1 PURINE DERIVATIVES AS KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2011-08-25 US disclosed
US-20090105229-A1 PURINE DERIVATIVES AS KINASE INHIBITORS ELI LILLY AND COMPANY 2009-04-23 US disclosed
EP-0772601-B1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION SEARLE & CO (US) 2002-09-18 EP disclosed
US-6426360-B1 ANTIARTHRITIC AGENTS G D SEARLE & CO. 2002-07-30 US disclosed
EP-1211244-A2 4,5-substitued imidazolyl compounds for the treatment of inflammation G.D. Searle & Co. (US) 2002-06-05 EP disclosed
EP-0772601-A1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP disclosed
US-5620999-A ANTIARTHRITIC, ANALGESIC AND ANTIPYRATIC AGENT G.D. SEARLE & CO. 1997-04-15 US disclosed
WO-1996003387-A1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 WO disclosed
US-4629737-A HYPOGLYCEMIC AGENTS; DIETETICS BEECHAM GROUP P.L.C. (GB) 1986-12-16 US disclosed
EP-0099707-B1 2-AMINOETHYL ETHER DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 1986-12-10 EP disclosed
EP-0099707-A1 2-Aminoethyl ether derivatives, processes for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1984-02-01 EP disclosed
US-3966768-A Substituted 1,3-dioxepins THE DOW CHEMICAL COMPANY (US) 1976-06-29 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 (3 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-20110294792-A1 PURINE DERIVATIVES AS KINASE INHIBITORS PNP, ADK, NME2 LMNA 3305/4885MAOA 3011/4885PTGS1 991/4885
US-20110207721-A1 PURINE DERIVATIVES AS KINASE INHIBITORS PNP, ADK, NME2 LMNA 3305/4885MAOA 3011/4885PTGS1 991/4885
US-20090105229-A1 PURINE DERIVATIVES AS KINASE INHIBITORS PNP, ADK, NME2 LMNA 3305/4885MAOA 3011/4885PTGS1 991/4885

“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.