SCHEMBL9950591

SCHEMBL9950591

COc1ccc(OCc2ccccc2)cn1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
PABPC1 P11940 1/20 0.63
P4HTM Q9NXG6 1/20 0.55
MAOB P27338 4/20 0.53
PDGFRB P09619 1/20 0.52
PDGFRA P16234 1/20 0.52
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
CYP2C19 P33261 1/20 0.50
PTGS2 P35354 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HIF1A Q16665 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
MAOA P21397 1/20 0.49
RAB9A P51151 1/20 0.49

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
Formic Acid Methyl Ester SCHEMBL27529952 0.91 MEN1 (0.58) MEN1KMT2APABPC1P4HTMMAOB
Formic Acid SCHEMBL27523068 0.91 MEN1 (0.62) MEN1KMT2APABPC1P4HTMMAOB
SCHEMBL5183487 0.88 APP (0.56) MEN1KMT2APABPC1MAOBRAB9A
SCHEMBL6208078 0.86 MEN1 (0.60) MEN1KMT2APABPC1MAOBLMNA
SCHEMBL17544483 0.83 NPC1 (0.51) MEN1KMT2APABPC1RAB9A
SCHEMBL5183041 0.83 MEN1 (0.56) MEN1KMT2APABPC1MAOBLMNA
SCHEMBL6209712 0.82 MEN1 (0.56) MEN1KMT2APABPC1MAOBLMNA
SCHEMBL1936414 0.82 P4HTM (0.48) MEN1KMT2APABPC1P4HTMMAOB
SCHEMBL6645927 0.80 P4HTM (0.60) MEN1KMT2APABPC1P4HTMMAOB
SCHEMBL6684242 0.79 SYK (0.52) CYP1A2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110770240-A Modulators of indoleamine2, 3-dioxygenase 葛兰素史克知识产权开发有限公司 2020-02-07 CN disclosed
CN-108883099-A THIAZOLIDINONE COMPOUNDS AND USE THEREOF 石全 2018-11-23 CN disclosed
US-9802941-B2 Compounds and methods for inhibiting histone demethylases GILEAD SCIENCES, INC. (US) 2017-10-31 US disclosed
US-9802941-B2 Compounds and methods for inhibiting histone demethylases GILEAD SCIENCES, INC. (US) 2017-10-31 US disclosed
US-9802941-B2 Compounds and methods for inhibiting histone demethylases GILEAD SCIENCES, INC. (US) 2017-10-31 US disclosed
CN-107074807-A Compositions and methods for inhibiting histone demethylase 吉利德科学公司 2017-08-18 CN disclosed
EP-3186238-A1 COMPOUNDS AND METHODS FOR INHIBITING HISTONE DEMETHYLASES GILEAD SCIENCES, INC. (US) 2017-07-05 EP disclosed
US-20160102096-A1 COMPOUNDS AND METHODS FOR INHIBITING HISTONE DEMETHYLASES EPITHERAPEUTICS APS 2016-04-14 US disclosed
US-20160102096-A1 COMPOUNDS AND METHODS FOR INHIBITING HISTONE DEMETHYLASES EPITHERAPEUTICS APS 2016-04-14 US disclosed
US-20160102096-A1 COMPOUNDS AND METHODS FOR INHIBITING HISTONE DEMETHYLASES EPITHERAPEUTICS APS 2016-04-14 US disclosed
US-20120165339-A1 CYCLOPROPANE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-06-28 US disclosed
US-20120165339-A1 CYCLOPROPANE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-06-28 US disclosed
CN-102448937-A Aryl Substituted Carboxamide Derivatives As Calcium Or Sodium Channel Blockers RAQUALIA PHARMA INC 2012-05-09 CN disclosed
CN-102256983-A Spirooxindole compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC 2011-11-23 CN disclosed
CN-101384258-A FGF receptor agonist dimeric compounds SANOFI AVENTIS (FR) 2009-03-11 CN disclosed
CN-1237051-C Fungicidal heterocyclic aromatic amides and their compositions, methods of use and preparation DOW AGRO SCIENCES LLC (US) 2006-01-18 CN disclosed
CN-1208321-C Fungicidal heterocyclic aromatic amides and their compositions methods of use and preparation DOW AGROSCIENCES LLC (US) 2005-06-29 CN disclosed
CN-1450993-A Fungicidal heterocyclic aromatic amides and their compositions, methods of use and preparation DOW AGROSCIENCES LLC (US) 2003-10-22 CN disclosed
CN-1390204-A Fungicidal heterocyclic aromatic amides and their compositions, methods of use and preparation DOW AGRO SCIENCES LLC (US) 2003-01-08 CN disclosed
CN-1329596-A Pyridinecarboxamide derivative and pest control agent containing same as active ingredient MEIJI SEIKA KAISHA (JP) 2002-01-02 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 (2 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-20160102096-A1 COMPOUNDS AND METHODS FOR INHIBITING HISTONE DEMETHYLASES PHF8, KDM3A, PHF2 MEN1 3634/4885KMT2A 34/4885PABPC1 1892/4885
US-20120165339-A1 CYCLOPROPANE DERIVATIVES HCRTR2, HCRTR1, CNR1 MEN1 2871/4885KMT2A 1492/4885PABPC1 4296/4885

“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.