SCHEMBL765398

SCHEMBL765398

CC(=O)OC(CC(C)C)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.52
APOBEC3A P31941 1/20 0.52
APOBEC3G Q9HC16 1/20 0.52
ALDH1A1 P00352 3/20 0.49
CYP3A4 P08684 1/20 0.49
LMNA P02545 1/20 0.44
HCAR2 Q8TDS4 1/20 0.40
CTSK P43235 1/20 0.40
TSHR P16473 2/20 0.40
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP14 P50281 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP19A1 P11511 2/20 0.39
PGR P06401 1/20 0.39
PTGS1 P23219 1/20 0.39
PDE4A P27815 1/20 0.39

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
SCHEMBL20179578 1.00 PABPC1 (0.52) PABPC1APOBEC3AAPOBEC3GALDH1A1CYP3A4
SCHEMBL18759622 0.91 PABPC1 (0.56) PABPC1APOBEC3AAPOBEC3GALDH1A1CYP3A4
SCHEMBL28343201 0.84 ACHE (0.45) PABPC1APOBEC3AAPOBEC3GALDH1A1LMNA
SCHEMBL28346760 0.84 PABPC1 (0.51) PABPC1APOBEC3AAPOBEC3GALDH1A1CYP3A4
SCHEMBL28343199 0.84 ACHE (0.45) PABPC1APOBEC3AAPOBEC3GALDH1A1LMNA
SCHEMBL28346759 0.84 PABPC1 (0.51) PABPC1APOBEC3AAPOBEC3GALDH1A1CYP3A4
SCHEMBL4596085 0.83 ALDH1A1 (0.40) PABPC1APOBEC3AAPOBEC3GALDH1A1CYP3A4
SCHEMBL31274030 0.82 PABPC1 (0.47) PABPC1APOBEC3AAPOBEC3GALDH1A1CYP3A4
SCHEMBL9796155 0.82 LMNA (0.42) PABPC1APOBEC3AAPOBEC3GALDH1A1CYP3A4
SCHEMBL8467351 0.81 PABPC1 (0.55) PABPC1APOBEC3AAPOBEC3GALDH1A1CYP3A4

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110590552-B Synthetic method of acetate compound 青岛农业大学 2022-02-08 CN disclosed
CN-110590552-A Synthetic method of acetate compound 青岛农业大学 2019-12-20 CN disclosed
US-8642576-B2 Heterocyclic CETP inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-02-04 US disclosed
US-20120322761-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-12-20 US disclosed
US-8304403-B2 Heterocyclic CETP inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-11-06 US disclosed
US-8304403-B2 Heterocyclic CETP inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-11-06 US disclosed
EP-1954668-B9 HOMO- AND HETEROCYCLIC COMPOUNDS SUITABLE AS CETP INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2012-03-21 EP disclosed
US-20100267669-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-10-21 US disclosed
US-20100267669-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-10-21 US disclosed
US-7790770-B2 Heterocyclic CETP inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-09-07 US disclosed
CN-1910144-B Sulfonamide derivatives for the treatment of diseases PFIZER LTD 2010-06-09 CN disclosed
CN-100548976-C The sulfone amide derivative that is used for the treatment of disease PFIZER LTD (US) 2009-10-14 CN disclosed
US-7378413-B2 2-amino-3-(alkyl)-pyrimidone derivatives SANOFI AVENTIS (FR) 2008-05-27 US disclosed
US-7378413-B2 2-amino-3-(alkyl)-pyrimidone derivatives SANOFI AVENTIS (FR) 2008-05-27 US disclosed
US-20070161685-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-07-12 US disclosed
US-20070135631-A1 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2007-06-14 US disclosed
CN-1942432-A Phenylethanolamine derivatives as beta-2 agonists PFIZER LTD (US) 2007-04-04 CN disclosed
CN-1934071-A Carboxamide derivatives useful as adrenergic receptors PFIZER LTD (US) 2007-03-21 CN disclosed
CN-1910144-A Sulfonamide derivatives for the treatment of diseases PFIZER LTD (US) 2007-02-07 CN disclosed
CN-1910143-A Sulfonamide derivatives for the treatment of diseases PFIZER LTD (US) 2007-02-07 CN 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-20070161685-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 PABPC1 725/4885APOBEC3A 2043/4885APOBEC3G 2324/4885
US-20070135631-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 PABPC1 725/4885APOBEC3A 2043/4885APOBEC3G 2324/4885
US-20120322761-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 PABPC1 725/4885APOBEC3A 2043/4885APOBEC3G 2324/4885
US-20100267669-A1 HETEROCYCLIC CETP INHIBITORS CETP, CES1, NPC1 PABPC1 725/4885APOBEC3A 2043/4885APOBEC3G 2324/4885

“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.