SCHEMBL335267

SCHEMBL335267

O=[C]c1cccc(O)c1[C]=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.38
LMNA P02545 4/20 0.38
HPGD P15428 4/20 0.38
ALOX15 P16050 4/20 0.38
HSD17B10 Q99714 4/20 0.38
TDP1 Q9NUW8 4/20 0.38
CA1 P00915 3/20 0.38
ALDH1A1 P00352 3/20 0.38
RECQL P46063 3/20 0.38
EGFR P00533 2/20 0.38
FYN P06241 2/20 0.38
MMP9 P14780 2/20 0.38
MMP2 P08253 2/20 0.38
ADAMTS4 O75173 1/20 0.38
MMP8 P22894 1/20 0.38
CA6 P23280 1/20 0.38
CDK2 P24941 1/20 0.38
MMP12 P39900 1/20 0.38
ADAMTS5 Q9UNA0 1/20 0.38
CA12 O43570 3/20 0.36

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
SCHEMBL5780751 0.85 CA2 (0.45) CA2LMNAHPGDALOX15HSD17B10
SCHEMBL4850001 0.85 CA2 (0.33) CA2LMNAHPGDALOX15HSD17B10
SCHEMBL1965147 0.82 CYP3A4 (0.33) CYP3A4
SCHEMBL874656 0.78 ALDH1A1 (0.52) CA2LMNAHPGDALOX15HSD17B10
SCHEMBL671168 0.77
SCHEMBL7920276 0.75 CYP3A4 (0.30) CYP3A4
SCHEMBL571847 0.74 TRPA1 (0.50) CA2LMNAHPGDALOX15HSD17B10
SCHEMBL9097641 0.74 IDO1 (0.46) CA2LMNAHPGDALOX15HSD17B10
SCHEMBL2183097 0.74 G6PD (0.47) CA2LMNAHPGDALOX15HSD17B10
SCHEMBL7156428 0.74 CES2 (0.39) CA2LMNAHPGDALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2776382-B1 18F-SACCHARIDE-FOLATES Merck & Cie (CH) 2018-09-19 EP claimed
EP-3131897-B1 FACTOR IXA INHIBITORS MERCK SHARP & DOHME (US) 2022-06-15 EP disclosed
US-10973936-B2 18F-saccharide-folates Merck & Cie (CH) 2021-04-13 US disclosed
US-20190255200-A1 18F-SACCHARIDE-FOLATES Merck & Cie (CH) 2019-08-22 US disclosed
US-10322195-B2 18F-saccharide-folates Merck & Cie (CH) 2019-06-18 US disclosed
EP-3131896-B1 FACTOR IXA INHIBITORS MERCK SHARP & DOHME (US) 2019-01-30 EP disclosed
EP-2776382-B1 18F-SACCHARIDE-FOLATES Merck & Cie (CH) 2018-09-19 EP disclosed
US-9969724-B2 Factor IXa inhibitors MERCK SHARP & DOHME CORP. (US) 2018-05-15 US disclosed
US-9808445-B2 Factor IXa inhibitors MERCK SHARP & DOHME CORP. (US) 2017-11-07 US disclosed
US-20170129880-A1 FACTOR IXa INHIBITORS MERCK SHARP & DOHME LLC 2017-05-11 US disclosed
EP-0150202-B1 DI/TETRA-HYDROQUINOLINES BEECHAM GROUP PLC (GB) 1988-07-06 EP disclosed
EP-0218373-A2 Chroman derivatives and analogues having antihypertensive activity BEECHAM GROUP PLC (GB) 1987-04-15 EP disclosed
EP-0214743-A2 Use of quinoline derivatives in the manufacture of medicaments for the treatment of cerebrovascular disorders and cerebral senility BEECHAM GROUP PLC (GB) 1987-03-18 EP disclosed
US-4626524-A Antiviral peptides THE GENERAL HOSPITAL CORPORATION (US) 1986-12-02 US disclosed
EP-0191854-A1 ANTIVIRAL PEPTIDES THE GENERAL HOSPITAL CORPORATION (US) 1986-08-27 EP disclosed
WO-1986001408-A1 ANTIVIRAL PEPTIDES THE GENERAL HOSPITAL CORPORATION (US) 1986-03-13 WO disclosed
EP-0150202-A1 DI/TETRA-HYDROQUINOLINES. BEECHAM GROUP PLC (GB) 1985-08-07 EP disclosed
WO-1985000602-A1 DI/TETRA-HYDROQUINOLINES BEECHAM GROUP P.L.C. (GB) 1985-02-14 WO disclosed
US-4411899-A Substituted derivatives of amino alkane diols as gastric secretion inhibitors MERCK & CO., INC. (US) 1983-10-25 US disclosed
US-3962226-A 3-NITROOXYCEPHAM COMPOUNDS AND PROCESS FOR PREPARING DESACETOXYCEPHALOSPORINS THEREFROM ELI LILLY AND COMPANY (US) 1976-06-08 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-20170129880-A1 FACTOR IXa INHIBITORS F9, F12, TFPI CA2 908/4885LMNA 89/4885HPGD 1717/4885
US-10322195-B2 18F-saccharide-folates FOLR1, FOLR2, FOLH1 CA2 3602/4885LMNA 4857/4885HPGD 532/4885
US-10973936-B2 18F-saccharide-folates FOLR1, FOLR2, FOLH1 CA2 3502/4885LMNA 4865/4885HPGD 418/4885
US-20190255200-A1 18F-SACCHARIDE-FOLATES FOLR1, FOLR2, FOLH1 CA2 3502/4885LMNA 4865/4885HPGD 418/4885

“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.