SCHEMBL97561

SCHEMBL97561

CC(C=O)c1cccc(F)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
CES2 O00748 2/20 0.43
CES1 P23141 2/20 0.43
IDO1 P14902 1/20 0.41
TDO2 P48775 1/20 0.41
ACHE P22303 1/20 0.40
MTOR P42345 1/20 0.40
AOC3 Q16853 1/20 0.39
NFE2L2 Q16236 1/20 0.39
CNR2 P34972 1/20 0.37
KDM4E B2RXH2 1/20 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
SCHEMBL21628044 0.85 HDAC4 (0.38) HDAC4KDM4E
SCHEMBL14415736 0.82 HDAC4 (0.43) HDAC4HDAC7HDAC5CES2CES1
SCHEMBL7917545 0.79 HDAC4 (0.47) HDAC4HDAC7HDAC5CES2CES1
SCHEMBL2562362 0.79 HDAC4 (0.47) HDAC4HDAC7HDAC5CES2CES1
SCHEMBL14336934 0.79 CES2 (0.38) CES2CES1IDO1TDO2
SCHEMBL9870224 0.78 ACP3 (0.44) ACHEAOC3
SCHEMBL31490296 0.78 ACP3 (0.44) ACHEAOC3
SCHEMBL11743372 0.77 CYP1A2 (0.42)
SCHEMBL1046557 0.77 HDAC4 (0.48) HDAC4HDAC7HDAC5CES2CES1
SCHEMBL11834056 0.77 PTGS1 (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2763987-B1 HETEROCYCLYLPYRI(MI)DINYLPYRAZOLE AS FUNGICIDALS BAYER CROPSCIENCE AG (DE) 2018-07-18 EP claimed
US-9023844-B2 Heterocyclylpyri (mi) dinylpyrazole as fungicidals BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-05-05 US claimed
US-20140256677-A1 HETEROCYCLYLPYRI (MI) DINYLPYRAZOLE AS FUNGICIDALS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-09-11 US claimed
CN-104039785-A Heterocyclylpyrazoles as fungicides BAYER IP GMBH 2014-09-10 CN claimed
EP-2763987-A1 HETEROCYCLYLPYRI (MI) DINYLPYRAZOLE AS FUNGICIDALS Bayer Intellectual Property GmbH (DE) 2014-08-13 EP claimed
WO-2013050437-A1 HETEROCYCLYLPYRI (MI) DINYLPYRAZOLE AS FUNGICIDALS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-04-11 WO claimed
WO-2026047575-A1 HYDROQUINAZOLINE DERIVATIVES FOR THE TREATMENT OF A DISEASE OR DISORDER NOVARTIS AG (CH) 2026-03-05 WO disclosed
EP-4673431-A1 HYDROQUINAZOLINE DERIVATIVES FOR THE TREATMENT OF A DISEASE OR DISORDER Novartis AG (CH) 2026-01-07 EP disclosed
US-12129246-B1 Hydroquinazoline derivatives for the treatment of a disease or disorder NOVARTIS AG (CH) 2024-10-29 US disclosed
US-20240336598-A1 HYDROQUINAZOLINE DERIVATIVES FOR THE TREATMENT OF A DISEASE OR DISORDER NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2024-10-10 US disclosed
WO-2024180499-A1 HYDROQUINAZOLINE DERIVATIVES FOR THE TREATMENT OF A DISEASE OR DISORDER NOVARTIS AG (CH) 2024-09-06 WO disclosed
EP-2763987-B1 HETEROCYCLYLPYRI(MI)DINYLPYRAZOLE AS FUNGICIDALS BAYER CROPSCIENCE AG (DE) 2018-07-18 EP disclosed
US-9783500-B2 2-aminoquinoline-based compounds for potent and selective neuronal nitric oxide synthase inhibition NORTHWESTERN UNIVERSITY (US) 2017-10-10 US disclosed
US-7304076-B2 Neuropeptide Y Y5 receptor antagonists SCHERING CORPORATION (US) 2007-12-04 US disclosed
US-7304076-B2 Neuropeptide Y Y5 receptor antagonists SCHERING CORPORATION (US) 2007-12-04 US disclosed
CN-101068810-A Carbostyril compound OTSUKA PHARMA CO LTD (JP) 2007-11-07 CN disclosed
US-20070179173-A1 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 US disclosed
EP-1797082-A1 CARBOSTYRIL COMPOUND Otsuka Pharmaceutical Company, Limited (JP) 2007-06-20 EP disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 WO disclosed
CN-1553909-A Benzimidazole and pyridylimidazole derivatives as ligands for GABA receptors 2004-12-08 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-12129246-B1 Hydroquinazoline derivatives for the treatment of a disease or disorder RECQL, NRAS, RAB1A HDAC4 2346/4885HDAC7 1555/4885HDAC5 1943/4885
US-20140256677-A1 HETEROCYCLYLPYRI (MI) DINYLPYRAZOLE AS FUNGICIDALS CCNY, NQO2, H1-0 HDAC4 3265/4885HDAC7 2836/4885HDAC5 2247/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 HDAC4 2177/4885HDAC7 3871/4885HDAC5 2250/4885
US-20240336598-A1 HYDROQUINAZOLINE DERIVATIVES FOR THE TREATMENT OF A DISEASE OR DISORDER RECQL, NRAS, RAB1A HDAC4 2346/4885HDAC7 1555/4885HDAC5 1943/4885

“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.