SCHEMBL2653668

SCHEMBL2653668

O=CC1(C2CCCCC2)CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 3/20 0.32
ADH1C P00326 2/20 0.32
ADH1B P00325 1/20 0.32
ADH4 P08319 1/20 0.32
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL9158295 1.00 ADH1A (0.32) ADH1AADH1CADH1BADH4LMNA
SCHEMBL21457789 1.00 ADH1A (0.32) ADH1AADH1CADH1BADH4LMNA
SCHEMBL31476927 1.00 ADH1A (0.32) ADH1AADH1CADH1BADH4LMNA
SCHEMBL31476907 1.00 ADH1A (0.32) ADH1AADH1CADH1BADH4LMNA
SCHEMBL11827376 0.98 ADH1A (0.31) ADH1AADH1CADH1BADH4LMNA
SCHEMBL31008449 0.97 LMNA (0.32) LMNATSHR
SCHEMBL3465699 0.95 ADH1A (0.32) ADH1AADH1CADH1BADH4
SCHEMBL3180740 0.92 ADH1A (0.33) ADH1AADH1CADH1BADH4
SCHEMBL6588160 0.90
SCHEMBL19736192 0.84 EPHX1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114380815-A Phytoalexin derivative and preparation method and application thereof 河北工业大学 2022-04-22 CN claimed
CN-114380815-B Plant protection camalexin derivative and preparation method and application thereof 河北工业大学 2024-05-31 CN disclosed
CN-117241803-A Purine nucleosides, intermediates and methods of making the same 阿斯特罗赛特制药公司 2023-12-15 CN disclosed
CN-114380815-A Phytoalexin derivative and preparation method and application thereof 河北工业大学 2022-04-22 CN disclosed
CN-109790284-B Polyphenol compound and process for producing the same 三菱化学株式会社 2021-09-21 CN disclosed
US-10851039-B2 Polyhydric phenol compound and method of producing same MITSUBISHI CHEMICAL CORPORATION (JP) 2020-12-01 US disclosed
US-10793499-B2 2020-10-06 US disclosed
EP-3514193-A1 POLYVALENT PHENOL COMPOUND AND METHOD OF PRODUCING SAME Mitsubishi Chemical Corporation (JP) 2019-07-24 EP disclosed
US-20190210947-A1 POLYHYDRIC PHENOL COMPOUND AND METHOD OF PRODUCING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2019-07-11 US disclosed
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
US-20030220350-A1 Glucagon antagonists/inverse agonists PFIZER INC 2003-11-27 US disclosed
US-6503949-B1 Treating Type 2 diabetes, hyperglycemia, impaired glucose tolerance or obesity NORO NORDISK A/S (DK) 2003-01-07 US disclosed
EP-1183229-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-03-06 EP disclosed
EP-0637623-B1 Cyclic hydrocarbon derivative and liquid crystal composition containing the same DAINIPPON INK & CHEMICALS (JP) 2001-10-04 EP disclosed
WO-2000069810-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-11-23 WO disclosed
US-5536443-A DUTERIUM CONTAINING COMPOUNDS FOOR ELECTROOPTICAL APPARATUS DAINIPPON INK & CHEMICALS, INC. (JP) 1996-07-16 US disclosed
US-5474707-A Electrooptic display DAINIPPON INK AND CHEMICALS, INC. (JP) 1995-12-12 US disclosed
EP-0637623-A1 Cyclic hydrocarbon derivative and liquid crystal composition containing the same DAINIPPON INK AND CHEMICALS, INC. (JP) 1995-02-08 EP disclosed
US-4519925-A Sulfur-containing compounds and lubricants containing them THE LUBRIZOL CORPORATION (US) 1985-05-28 US disclosed
US-4129510-A Sulfur-containing compounds and lubricants and fuels containing them THE LUBRIZOL CORPORATION (US) 1978-12-12 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 (5 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-20190210947-A1 POLYHYDRIC PHENOL COMPOUND AND METHOD OF PRODUCING SAME RB1, FHIT, H1-4 ADH1A 646/4885ADH1C 467/4885ADH1B 123/4885
US-10851039-B2 Polyhydric phenol compound and method of producing same RB1, FHIT, H1-4 ADH1A 646/4885ADH1C 467/4885ADH1B 123/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR ADH1A 1628/4885ADH1C 1146/4885ADH1B 3930/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR ADH1A 1628/4885ADH1C 1146/4885ADH1B 3930/4885
US-10793499-B2 RB1, H1-4, TPD52L2 ADH1A 817/4885ADH1C 772/4885ADH1B 138/4885

“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.