SCHEMBL122429

SCHEMBL122429

Cc1ccc(CBr)cc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 7/20 0.37
ALKBH5 Q6P6C2 1/20 0.37
PYCR1 P32322 1/20 0.36
NOTUM Q6P988 1/20 0.36
PHGDH O43175 1/20 0.36
IDO1 P14902 2/20 0.36
S1PR1 P21453 2/20 0.36
DAO P14920 1/20 0.35
TAS2R14 Q9NYV8 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34

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
SCHEMBL29427034 1.00 OPRK1 (0.37) OPRK1ALKBH5PYCR1NOTUMPHGDH
SCHEMBL10659027 0.83 ESR1 (0.43) OPRK1ALKBH5NOTUMPHGDHIDO1
SCHEMBL10233484 0.82 PDE2A (0.41) OPRK1ALKBH5NOTUMPHGDHIDO1
SCHEMBL1775215 0.81 RXRA (0.44) PYCR1NOTUMIDO1DAO
SCHEMBL23349911 0.80 OPRK1 (0.40) OPRK1ALKBH5PYCR1NOTUMPHGDH
SCHEMBL4550423 0.80 LOXL2 (0.43) OPRK1ALKBH5NOTUMPHGDHIDO1
SCHEMBL16953204 0.80 KIF11 (0.47) OPRK1ALKBH5NOTUMPHGDHIDO1
SCHEMBL10026822 0.78 ESR1 (0.41) OPRK1ALKBH5NOTUMPHGDHIDO1
SCHEMBL12114003 0.78 CTSS (0.46) OPRK1S1PR1DAOCTSSCTSK
Hydrochloric Acid SCHEMBL23166308 0.78 LOXL2 (0.44) OPRK1ALKBH5NOTUMPHGDHIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260085028-A1 P-XYLENE CYCLIC DIMER DERIVATIVE FOR PREPARING PARYLENE FILM, AND PREPARATION METHOD AND USE THEREOF UNIV SOOCHOW (CN) 2026-03-26 US disclosed
US-12577257-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2026-03-17 US disclosed
EP-4474017-A2 NEW HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-12-11 EP disclosed
US-20240376048-A1 Carboxylic Acid Containing Indanyl Compounds for the Treatment of Neurodegenerative Diseases CELGENE CORPORATION (US) 2024-11-14 US disclosed
EP-4217062-B1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2024-10-09 EP disclosed
EP-3837263-B1 NEW HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN LA ROCHE (CH) 2024-07-03 EP disclosed
US-20240208902-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2024-06-27 US disclosed
US-11802111-B2 Cyclobutyl amide monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-10-31 US disclosed
EP-3883936-B1 NEW HETEROCYCLIC COMPOUNDS HOFFMANN LA ROCHE (CH) 2023-07-12 EP disclosed
CN-116323557-A Cyclobutylamide monoacylglycerol lipase modulators 詹森药业有限公司 2023-06-23 CN disclosed
US-20070244148-A1 Imidazo 4,5-C Pyridine Compounds and Methods of Antiviral Treatment KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2007-10-18 US disclosed
US-20070244148-A1 Imidazo 4,5-C Pyridine Compounds and Methods of Antiviral Treatment KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2007-10-18 US disclosed
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 US disclosed
CN-1950375-A Glucocorticoid receptor modulator compounds and methods- utility LIGAND PHARM INC (US) 2007-04-18 CN disclosed
CN-1906155-A Novel hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA AS (DK) 2007-01-31 CN disclosed
WO-2007002433-A1 PYRROLO [2, 3-B] PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2007-01-04 WO disclosed
EP-1718653-A1 GLUCOCORTICOID RECEPTOR MODULATOR COMPOUNDS AND METHODS- UTILITY Ligand Pharmaceuticals Inc. (US) 2006-11-08 EP disclosed
EP-1697312-A2 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF Leo Pharma A/S (DK) 2006-09-06 EP disclosed
WO-2005082909-A1 GLUCOCORTICOID RECEPTOR MODULATOR COMPOUNDS AND METHODS- UTILITY LIGAND PHARMACEUTICALS INCORPORATED (US) 2005-09-09 WO disclosed
WO-2005054179-A2 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA A/S (DK) 2005-06-16 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 (7 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-20260085028-A1 P-XYLENE CYCLIC DIMER DERIVATIVE FOR PREPARING PARYLENE FILM, AND PREPARATION METHOD AND USE THEREOF F12, F2, PF4 OPRK1 4558/4885ALKBH5 1899/4885PYCR1 3099/4885
US-20240376048-A1 Carboxylic Acid Containing Indanyl Compounds for the Treatment of Neurodegenerative Diseases S1PR5, S1PR2, LPAR5 OPRK1 2342/4885ALKBH5 229/4885PYCR1 101/4885
US-20070244148-A1 Imidazo 4,5-C Pyridine Compounds and Methods of Antiviral Treatment ZC3HAV1, TPMT, DPP4 OPRK1 1857/4885ALKBH5 413/4885PYCR1 394/4885
US-20240208902-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS MGLL, LPL, PNLIP OPRK1 233/4885ALKBH5 2683/4885PYCR1 2853/4885
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof F9, F12, HDAC9 OPRK1 3328/4885ALKBH5 2960/4885PYCR1 1959/4885
US-11802111-B2 Cyclobutyl amide monoacylglycerol lipase modulators MGLL, LPL, PNLIP OPRK1 235/4885ALKBH5 2604/4885PYCR1 2828/4885
US-12577257-B2 Heterocyclic compounds H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR1, CBR3 OPRK1 1109/4885ALKBH5 3692/4885PYCR1 1019/4885

“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.