SCHEMBL53331

SCHEMBL53331

CCOC(=O)CC(=O)COCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPID Q08752 1/20 0.49
CSNK1D P48730 1/20 0.48
NPC1 O15118 2/20 0.48
ALDH1A1 P00352 5/20 0.46
L3MBTL1 Q9Y468 3/20 0.45
MAPK1 P28482 1/20 0.45
GAA P10253 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NR1H4 Q96RI1 1/20 0.44
ABCB1 P08183 1/20 0.43
LMNA P02545 2/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.42
MGAM O43451 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
POLB P06746 1/20 0.42
HSD17B10 Q99714 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
SCHEMBL2042795 0.97 PPID (0.47) PPIDCSNK1DNPC1ALDH1A1L3MBTL1
SCHEMBL11525397 0.89 ALDH1A1 (0.58) NPC1ALDH1A1L3MBTL1MAPK1RAB9A
SCHEMBL128759 0.88 NPC1 (0.46) CSNK1DNPC1ALDH1A1L3MBTL1MAPK1
SCHEMBL6567531 0.88 GAA (0.48) NPC1ALDH1A1MAPK1GAARAB9A
SCHEMBL6565313 0.88 ALDH1A1 (0.43) CSNK1DALDH1A1GAAMAPTTSHR
SCHEMBL52219 0.87 ALDH1A1 (0.52) PPIDCSNK1DNPC1ALDH1A1L3MBTL1
SCHEMBL6567425 0.85 L3MBTL1 (0.55) NPC1ALDH1A1L3MBTL1MAPK1RAB9A
SCHEMBL126148 0.85 NPC1 (0.55) CSNK1DNPC1ALDH1A1L3MBTL1MAPK1
SCHEMBL4803036 0.85 ABCB1 (0.47) PPIDL3MBTL1SMN1; SMN2ABCB1LMNA
SCHEMBL14487004 0.85 ALDH1A1 (0.48) CSNK1DNPC1ALDH1A1GAARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108314643-A A kind of synthetic method of nitrendipine metabolin 梯尔希(南京)药物研发有限公司 2018-07-24 CN claimed
EP-0912467-B1 ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE RHODIA CHIMIE SA (FR) 2002-04-24 EP claimed
EP-0577040-B1 Process for the preparation of (3R,5S)-6-hydroxy-3,5-O-isopropylidene-3,5-dihydroxy-hexanoic acid, tert.-butyl ester HOECHST AG (DE) 1997-09-24 EP claimed
US-5399722-A Process for preparing tert-butyl (3R,5S)-6-hydroxy-3,5--O--isopropylidene-3,5-dihydroxyhexanoate HOECHST AKTIENGESELLSCHAFT (DE) 1995-03-21 US claimed
JP-6087851-A None JP disclosed
US-12584153-B2 Enzyme-mediated process for making Amberketal and Amberketal homologues GIVAUDAN SA (CH) 2026-03-24 US disclosed
US-20250230162-A1 METHODS AND INTERMEDIATES FOR PREPARING THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2025-07-17 US disclosed
WO-2025137231-A1 METHODS AND INTERMEDIATES FOR PREPARING THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. (US) 2025-06-26 WO disclosed
EP-4570313-A2 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2025-06-18 EP disclosed
US-20250066361-A1 5,6,7,7a-Tetrahydrocyclopenta[f]pyrido[1,2-h][1,7] naphthyridin-11(4bH)-one Compounds and Methods of use Use (as amended) GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2025-02-27 US disclosed
US-12221444-B2 5,6,7,7a-tetrahydrocyclopenta[f]pyrido[1,2-h][1,7]naphthyridin-11(4bH)-one compounds and methods of use GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2025-02-11 US disclosed
US-20250009742-A1 NOVEL CAPSID ASSEMBLY INHIBITORS META-IMMUNE, INC. (KR) 2025-01-09 US disclosed
EP-0583171-A2 (3R,5S)-3,5,6-trihydroxyhexanoic acid derivatives and methods for their production Takasago International Corporation (JP) 1994-02-16 EP disclosed
US-5286883-A (3R,5S)-3,5,6-trihydroxyhexanoic acid derivative and production method thereof TAKASAGO INTERNATIONAL CORPORATION (JP) 1994-02-15 US disclosed
WO-1991018887-A1 DIAMINOPYRIMIDINE COMPOUNDS SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1991-12-12 WO disclosed
US-4933482-A HYDROGENATION OF BETA-KETO ACID IN PRESENCE OF RUTHENIUM PHOSPHINE COMPLEX TAKASAGO INTERNATIONAL CORPORATION (JP) 1990-06-12 US disclosed
US-4923865-A Substituted 1-(1H-imidazol-4-yl)alkyl-benzamides as anti-ischemics and as alpha-2-adrenergic receptor agonists U C B SOCIETE ANONYME (BE) 1990-05-08 US disclosed
EP-0295109-A1 Process for preparing optically active alcohol Takasago International Corporation (JP) 1988-12-14 EP disclosed
US-4720572-A Process for the preparation of 4-acyloxy-3-oxo-butyric acid esters BAYER AKTIENGESELLSCHAFT (DE) 1988-01-19 US disclosed
US-4421922-A Process for the production of tetronic acid LONZA LTD. (CH) 1983-12-20 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-12221444-B2 5,6,7,7a-tetrahydrocyclopenta[f]pyrido[1,2-h][1,7]naphthyridin-11(4bH)-one compounds and methods of use HAVCR2, HBS1L, HBG1 PPID 535/4885CSNK1D 3143/4885NPC1 70/4885
US-20250066361-A1 5,6,7,7a-Tetrahydrocyclopenta[f]pyrido[1,2-h][1,7] naphthyridin-11(4bH)-one Compounds and Methods of use Use (as amended) HAVCR2, HMBS, HBS1L PPID 908/4885CSNK1D 3172/4885NPC1 173/4885
US-20250009742-A1 NOVEL CAPSID ASSEMBLY INHIBITORS ZC3HAV1, ZC3HAV1L, MAVS PPID 1931/4885CSNK1D 3344/4885NPC1 1506/4885
US-12584153-B2 Enzyme-mediated process for making Amberketal and Amberketal homologues ALKBH5, AMD1, ALKBH1 PPID 1191/4885CSNK1D 1075/4885NPC1 4455/4885
US-20250230162-A1 METHODS AND INTERMEDIATES FOR PREPARING THERAPEUTIC COMPOUNDS CYP11B1, CYP11A1, CYP11B2 PPID 2010/4885CSNK1D 1685/4885NPC1 43/4885

“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.