SCHEMBL3625818

SCHEMBL3625818

Oc1ccc(OCc2cccc(F)c2)cc1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 14/20 0.73
NR4A2 P43354 2/20 0.69
PARP10 Q53GL7 1/20 0.68
MAOA P21397 1/20 0.62
LMNA P02545 1/20 0.61
CYP1A2 P05177 1/20 0.61
PTGS1 P23219 1/20 0.61
SLC6A2 P23975 1/20 0.61
CYP2C19 P33261 1/20 0.61
PTGS2 P35354 1/20 0.61
SLC6A3 Q01959 1/20 0.61
HIF1A Q16665 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61

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
SCHEMBL27521276 0.89 MAOB (0.77) MAOBNR4A2PARP10MAOA
SCHEMBL5633862 0.87 LMNA (0.73) MAOBNR4A2LMNACYP1A2PTGS1
SCHEMBL4228288 0.86 MAOB (0.73) MAOBNR4A2PARP10MAOA
SCHEMBL29817726 0.86 MAOB (0.73) MAOBNR4A2PARP10MAOA
SCHEMBL15171108 0.86 MAOB (0.73) MAOBNR4A2PARP10MAOA
SCHEMBL11959694 0.85 MAOB (0.72) MAOBNR4A2PARP10MAOA
SCHEMBL2559641 0.85 MAOB (0.67) MAOBNR4A2PARP10MAOA
SCHEMBL4552204 0.84 MAOB (0.71) MAOBNR4A2PARP10MAOA
SCHEMBL1379497 0.84 MAOB (1.00) MAOBNR4A2PARP10MAOA
SCHEMBL22874674 0.84 MAOB (0.71) MAOBNR4A2PARP10MAOALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3760633-B1 OXAZINO-QUINAZOLINE AND OXAZINO-QUINAZOLINE TYPE COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2021-12-15 EP disclosed
WO-2019170088-A1 OXAZINO-QUINAZOLINE AND OXAZINO-QUINAZOLINE TYPE COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF 北京赛特明强医药科技有限公司 2019-09-12 WO disclosed
EP-2036878-B1 PROCESS FOR PRODUCTION OF ALCOHOL COMPOUND SUMITOMO CHEMICAL CO (JP) 2012-08-22 EP disclosed
US-7745669-B2 Process for production of alcohol compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-29 US disclosed
CN-100554244-C New MAO-B inhibitor HOFFMANN LA ROCHE (CH) 2009-10-28 CN disclosed
US-20090259074-A1 PROCESS FOR PRODUCTION OF ALCOHOL COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-10-15 US disclosed
US-7598266-B2 Fused heterocyclic derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2009-10-06 US disclosed
US-7544707-B2 Bicyclic derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2009-06-09 US disclosed
EP-2036878-A1 PROCESS FOR PRODUCTION OF ALCOHOL COMPOUND Sumitomo Chemical Company, Limited (JP) 2009-03-18 EP disclosed
US-20090054479-A1 FUSED HETEROCYCLIC DERIVATIVES AS PPAR MODULATORS CONNER SCOTT EUGENE 2009-02-26 US disclosed
WO-2006000324-A2 NEW MAO-B INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2006-01-05 WO disclosed
US-20050288367-A1 Benzyloxy derivatives as MAOB inhibitors HOFFMAN-LA ROCHE INC. 2005-12-29 US disclosed
EP-1585726-A1 FUSED HETEROCYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-10-19 EP disclosed
WO-2005066136-A1 BICYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-07-21 WO disclosed
WO-2005019151-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-03 WO disclosed
WO-2004063155-A1 FUSED HETEROCYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2004-07-29 WO disclosed
WO-1984000106-A1 ANESTHETIC-ANTIPRURITIC N-(3-(4-(3-FLUOROBENZYLOXY)PHENOXY)PROPYL)MORPHOLINE COMPOUNDS, COMPOSITIONS AND USE STIEFEL LABORATORIES (US) 1984-01-19 WO disclosed
WO-1984000106-A1 ANESTHETIC-ANTIPRURITIC N-(3-(4-(3-FLUOROBENZYLOXY)PHENOXY)PROPYL)MORPHOLINE COMPOUNDS, COMPOSITIONS AND USE STIEFEL LABORATORIES (US) 1984-01-19 WO disclosed
US-4393061-A Anesthetic-antipruritic morpholine compounds, compositions and use STIEFEL LABORATORIES, INC. (US) 1983-07-12 US disclosed
US-4393061-A Anesthetic-antipruritic morpholine compounds, compositions and use STIEFEL LABORATORIES, INC. (US) 1983-07-12 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 (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-20050288367-A1 Benzyloxy derivatives as MAOB inhibitors MAOB, MAOA, COMT MAOB 1/4885NR4A2 1668/4885PARP10 1329/4885
US-20090054479-A1 FUSED HETEROCYCLIC DERIVATIVES AS PPAR MODULATORS PPARA, PPARG, PPARD MAOB 1278/4885NR4A2 48/4885PARP10 3393/4885
US-20090259074-A1 PROCESS FOR PRODUCTION OF ALCOHOL COMPOUND XDH, ADH5, ADH1A MAOB 499/4885NR4A2 835/4885PARP10 1285/4885

“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.