SCHEMBL321317

SCHEMBL321317

CC(C)(C)OC(=O)CCC(N)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
CYP2D6 P10635 1/20 0.38
NOS1 P29475 2/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
SLC1A1 P43005 1/20 0.33
APP P05067 1/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
APLNR P35414 1/20 0.33
STING1 Q86WV6 1/20 0.32
GABRP O00591 2/20 0.31
GABRD O14764 2/20 0.31
GABRA1 P14867 2/20 0.31
GABRB1 P18505 2/20 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
SCHEMBL11193635 0.88 HDAC8 (0.38) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL29278340 0.86 EPHX2 (0.38) HDAC3HDAC1HDAC2HDAC8HDAC6
Biphenyl SCHEMBL28145666 0.85 MTNR1A (0.40) HDAC1CTSK
SCHEMBL28302938 0.85 HDAC3 (0.38) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL31301833 0.85 ANPEP (0.38) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL4230480 0.85 EPHX2 (0.40) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL19143345 0.84 HDAC3 (0.38) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL22151802 0.84 HDAC3 (0.41) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL1555914 0.83 GABRP (0.50) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL5197380 0.83 GABRP (0.50) HDAC3HDAC1HDAC2HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116500858-A Coating of combined photoresist and Si-based hard mask 上海艾深斯科技有限公司 2023-07-28 CN claimed
CN-119019417-A Pyrazole five-membered ring macrocyclic derivative and preparation method and application thereof 山东绿叶制药有限公司 2024-11-26 CN disclosed
EP-3375774-B1 PHENALEN-1-ONE-CONTAINING PHOTOSENSITIZER COMPOSITION, PHENALEN-1-ONE COMPOUNDS AND THEIR USE JUFICO GMBH (DE) 2024-11-13 EP disclosed
US-11987557-B2 Phenalene-1-one-containing photosensitizer composition, phenalene-1-one compound and the use thereof TRIOPTOTEC GMBH (DE) 2024-05-21 US disclosed
CN-115380026-B Protein degradation modulators and methods of use thereof 南京明德新药研发有限公司 2023-11-07 CN disclosed
CN-116500858-A Coating of combined photoresist and Si-based hard mask 上海艾深斯科技有限公司 2023-07-28 CN disclosed
CN-114560850-A Near-infrared fluorescent molecular probe, and preparation method and application thereof 中国药科大学 2022-05-31 CN disclosed
US-20220064114-A1 PHENALENE-1-ONE-CONTAINING PHOTOSENSITIZER COMPOSITION, PHENALENE-1-ONE COMPOUND AND THE USE THEREOF TRIOPTOTEC GMBH (DE) 2022-03-03 US disclosed
US-11186545-B2 Phenalene-1-one-containing photosensitizer composition, phenalene-1-one compound and the use thereof TRIOPTOTEC GMBH (DE) 2021-11-30 US disclosed
CN-111253370-B N-polysubstituted pyridine-2-aminopyrimidine derivatives and application thereof 浙江大学 2021-08-03 CN disclosed
CN-1077109-C S type 2-substituted hydroxy-2-indolidinylbutyric ester compound and preparation method thereof TANABE SEIYAKU CO (JP) 2002-01-02 CN disclosed
US-6299597-B1 Percutaneous repair of cardiovascular anomalies and repair compositions SCIMED LIFE SYSTEMS, INC. 2001-10-09 US disclosed
CN-1313286-A S-type 4-substituted hydroxypyranoindolidine compound and its derivative and preparation method thereof TANABE SEIYAKU CO (JP) 2001-09-19 CN disclosed
WO-2001004134-A2 NOVEL ESTERS DERIVED FROM NUCLEOSIDES, PREPARATION METHODS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM LABORATOIRES LAPHAL S.A. (FR) 2001-01-18 WO disclosed
EP-0999856-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION Du Pont Pharmaceuticals Company (US) 2000-05-17 EP disclosed
CN-1239895-A Radiopharmaceuticals for imaging sites of infection and inflammation DU PONT MERCK PHARMA (US) 1999-12-29 CN disclosed
CN-1183414-A S-type 2-substituted hydroxy-2-indolidinylbutyric ester compound and process for producing the same TANABE SEIYAKU CO (JP) 1998-06-03 CN disclosed
WO-1998015295-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION DUPONT PHARMACEUTICALS COMPANY (US) 1998-04-16 WO disclosed
US-5468854-A Characterization of specific drug receptors with fluorescent ligands PHARMACEUTICAL DISCOVERY CORPORATION (US) 1995-11-21 US disclosed
WO-1995008289-A2 PERCUTANEOUS REPAIR OF CARDIOVASCULAR ANOMALIES AND REPAIR COMPOSITIONS SCIMED LIFE SYSTEMS, INC. (US) 1995-03-30 WO 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-11987557-B2 Phenalene-1-one-containing photosensitizer composition, phenalene-1-one compound and the use thereof PYCR1, CRY1, PPOX HDAC3 3465/4885HDAC1 1229/4885HDAC2 2897/4885
US-11186545-B2 Phenalene-1-one-containing photosensitizer composition, phenalene-1-one compound and the use thereof PYCR1, CRY1, PPOX HDAC3 3465/4885HDAC1 1229/4885HDAC2 2897/4885
US-20220064114-A1 PHENALENE-1-ONE-CONTAINING PHOTOSENSITIZER COMPOSITION, PHENALENE-1-ONE COMPOUND AND THE USE THEREOF PYCR1, CRY1, PPOX HDAC3 3465/4885HDAC1 1229/4885HDAC2 2897/4885

“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.