SCHEMBL508237

SCHEMBL508237

Oc1ccc(-c2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.57
TPX2 Q9ULW0 1/20 0.57
ESR2 Q92731 3/20 0.52
KIF11 P52732 2/20 0.52
ESR1 P03372 3/20 0.50
AKR1C2 P52895 1/20 0.49
AKR1C1 Q04828 1/20 0.49
MAPT P10636 1/20 0.47
EPHX2 P34913 1/20 0.47
SCN5A Q14524 6/20 0.45
NISCH Q9Y2I1 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SCN1A P35498 1/20 0.44
SCN2A Q99250 1/20 0.44

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
SCHEMBL221511 0.93 MAPT (0.52) AURKATPX2ESR2ESR1MAPT
SCHEMBL9589201 0.86 MEN1 (0.64) AURKATPX2ESR2ESR1MAPT
SCHEMBL4307301 0.86 MEN1 (0.64) AURKATPX2ESR2ESR1MAPT
SCHEMBL12952736 0.85 AURKA (0.71) AURKATPX2KIF11AKR1C2AKR1C1
SCHEMBL1690017 0.85 AURKA (0.71) AURKATPX2KIF11ESR1AKR1C2
SCHEMBL21944789 0.82 AURKA (0.67) AURKATPX2KIF11AKR1C2AKR1C1
SCHEMBL7938064 0.81 NR1H2 (0.56) AURKATPX2ESR2ESR1MAPT
SCHEMBL7729335 0.81 GPR84 (0.59) ESR2ESR1MAPTEPHX2
SCHEMBL7938063 0.81 ESR1 (0.56) ESR2ESR1MAPTEPHX2
SCHEMBL15146260 0.81 MAPT (0.56) KIF11MAPTEPHX2SCN5AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7459472-B2 Aryl and heteroaryl compounds, compositions, and methods of use TRANSTECH PHARMA, INC. (US) 2008-12-02 US claimed
US-20050059713-A1 Aryl and heteroaryl compounds, compositions, and methods of use VTVX HOLDINGS I LLC 2005-03-17 US claimed
WO-2005014534-A1 ARYL AND HETEROARYL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE TRANSTECH PHARMA, INC. (US) 2005-02-17 WO claimed
US-11384055-B2 Glycolate oxidase inhibitors for the treatment of disease BIOMARIN PHARMACEUTICAL INC. (US) 2022-07-12 US disclosed
US-20210171474-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2021-06-10 US disclosed
WO-2020257487-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2020-12-24 WO disclosed
CN-108264631-A Curing agent and the resin combination for having used the curing agent 协立化学产业株式会社 2018-07-10 CN disclosed
US-9541690-B2 Film using polymerizable liquid crystal composition containing peeling preventive agent JNC CORPORATION (JP) 2017-01-10 US disclosed
US-9198913-B2 Nitroimidazooxazines and their uses in anti-tubercular therapy GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT (US) 2015-12-01 US disclosed
EP-2459571-B1 NITROIMIDAZOOXAZINES AND THEIR USES IN ANTI-TUBERCULAR THERAPY GLOBAL ALLIANCE FOR TB DRUG DEV (US) 2015-03-11 EP disclosed
US-20140308462-A1 FILM USING POLYMERIZABLE LIQUID CRYSTAL COMPOSITION CONTAINING PEELING PREVENTIVE AGENT JNC PETROCHEMICAL CORPORATION (JP) 2014-10-16 US disclosed
US-6235786-B1 RHEUMATIC DISORDERS; BONE DISORDERS; ORAL DISEASES; ANTIULCER AGENTS; ANTITUMOR AGENTS ABBOTT LABORATORIES 2001-05-22 US disclosed
CN-1261876-A N-hydroxyformamide derivatives as inhibitors of matrix metalloproteinases ABBOTT LAB (US) 2000-08-02 CN disclosed
EP-1013629-A1 Preparation process of fluorine subsituted aromatic compound Mitsui Chemicals, Inc. (JP) 2000-06-28 EP disclosed
EP-1001930-A2 N-HYDROXYFORMAMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES Abbott Laboratories (US) 2000-05-24 EP disclosed
EP-0679633-B1 Diaminobenzene derivatives and polyimides prepared therefrom NISSAN CHEMICAL IND LTD (JP) 1999-11-03 EP disclosed
WO-1999006361-A2 N-HYDROXYFORMAMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 1999-02-11 WO disclosed
US-5861534-A CHEMICAL INTERMEDIATES NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1999-01-19 US disclosed
US-5665856-A Diaminobenzene derivatives and polyimides prepared therefrom NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1997-09-09 US disclosed
EP-0679633-A1 Diaminobenzene derivatives and polyimides prepared therefrom NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1995-11-02 EP 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-11384055-B2 Glycolate oxidase inhibitors for the treatment of disease XDH, PNPO, AGXT AURKA 4837/4885TPX2 378/4885ESR2 4547/4885
US-20210171474-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE XDH, PNPO, AGXT AURKA 4837/4885TPX2 378/4885ESR2 4547/4885
US-20050059713-A1 Aryl and heteroaryl compounds, compositions, and methods of use CYP2F1, CYP3A43, PNPO AURKA 1693/4885TPX2 199/4885ESR2 2182/4885

“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.