SCHEMBL523273

SCHEMBL523273

O=C1CC(c2ccccc2)N1c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.62
ESR2 Q92731 1/20 0.62
PAX8 Q06710 1/20 0.46
ALDH1A1 P00352 4/20 0.45
RIPK1 Q13546 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
GFER P55789 1/20 0.42
BRD4 O60885 3/20 0.42
KMT2A Q03164 2/20 0.42
TSHR P16473 1/20 0.42
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
RECQL P46063 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL23064534 0.88 ESR1 (0.58) ESR1ESR2PAX8ALDH1A1RIPK1
SCHEMBL5205886 0.88 ESR1 (0.58) ESR1ESR2ALDH1A1TDP1BRD4
SCHEMBL13921507 0.88 ESR1 (0.84) ESR1ESR2PAX8ALDH1A1KMT2A
SCHEMBL15841548 0.84 GFER (0.60) ESR1ESR2ALDH1A1TDP1GFER
SCHEMBL1997854 0.84 L3MBTL1 (0.56) ESR1ESR2ALDH1A1GFERKMT2A
SCHEMBL15841547 0.84 GFER (0.60) ESR1ESR2ALDH1A1TDP1GFER
SCHEMBL29975007 0.84 L3MBTL1 (0.56) ESR1ESR2ALDH1A1GFERKMT2A
SCHEMBL10574313 0.82 HDAC6 (0.56) ESR1ESR2ALDH1A1TSHRLMNA
SCHEMBL3739324 0.81 HDAC6 (0.54) ESR1ESR2
SCHEMBL11133372 0.78 RIPK1 (0.45) ESR1ESR2ALDH1A1RIPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100509781-C Process for preparing 1, 4-diphenylazetidinone derivatives SANOFI AVENTIS DEUTSCHLAND (DE) 2009-07-08 CN claimed
US-7488818-B2 Method for producing 1,4-diphenyl azetidinone derivatives SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-02-10 US claimed
WO-2008157537-A2 COMPOSITIONS AND METHODS OF USE FOR TREATING OR PREVENTING LIPID RELATED DISORDERS IRONWOOD PHARMACEUTICALS, INC (US) 2008-12-24 WO claimed
WO-2008124505-A2 SOLUBLE GUANYLATE CYCLASE (SGC) MODULATORS FOR TREATMENT OF LIPID RELATED DISORDERS IRONWOOD PHARMACEUTICALS,INC. (US) 2008-10-16 WO claimed
WO-2008057948-A2 PROCESSES FOR PRODUCTION OF DIPHENYLYLAZETIDIN-2-ONES AND RELATED COMPOUNDS IRONWOOD PHARMACEUTICALS, INC. (US) 2008-05-15 WO claimed
EP-1756049-B1 METHOD FOR PRODUCING 1,4-DIPHENYL AZETIDINONE DERIVATIVES SANOFI AVENTIS DEUTSCHLAND (DE) 2007-10-31 EP claimed
US-20070149776-A1 METHOD FOR PRODUCING 1,4-DIPHENYL AZETIDINONE DERIVATIVES SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-06-28 US claimed
CN-1953961-A Process for preparing 1, 4-diphenylazetidinone derivatives SANOFI AVENTIS DEUTSCHLAND (DE) 2007-04-25 CN claimed
US-20200113968-A1 AGONISTS OF GUANYLATE CYCLASE USEFUL FOR DOWNREGULATION OF PRO-INFLAMMATORY CYTOKINES BAUSCH HEALTH IRELAND LTD (IE) 2020-04-16 US disclosed
US-10597424-B2 Agonists of guanylate cyclase and their uses BAUSCH HEALTH IRELAND LIMITED (IE) 2020-03-24 US disclosed
US-20190262420-A1 COMPOSITIONS USEFUL FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS SYNERGY PHARMACEUTICALS INC (US) 2019-08-29 US disclosed
US-20190263861-A1 AGONISTS OF GUANYLATE CYCLASE AND THEIR USES JPMORGAN CHASE BANK, N.A. 2019-08-29 US disclosed
US-10238712-B2 Compositions useful for the treatment of gastrointestinal disorders SYNERGY PHARMACEUTICALS, INC. (US) 2019-03-26 US disclosed
US-10118946-B2 Agonists of guanylate cyclase and their uses SYNERGY PHARMACEUTICALS INC. (US) 2018-11-06 US disclosed
WO-2005021495-A3 QUATERNARY SALT DERIVATIVES OF 1,4-DIPHENYLAZETIDIN-2-ONES MICROBIA INC (US) 2005-04-28 WO disclosed
WO-2005021497-A2 TETHERED DIMERS AND TRIMERS OF 1,4-DIPHENYLAZETIDN-2-ONES MICROBIA, INC. (US) 2005-03-10 WO disclosed
WO-2005021497-A2 TETHERED DIMERS AND TRIMERS OF 1,4-DIPHENYLAZETIDN-2-ONES MICROBIA, INC. (US) 2005-03-10 WO disclosed
WO-2005021495-A2 QUATERNARY SALT DERIVATIVES OF 1,4-DIPHENYLAZETIDIN-2-ONES MICROBIA INC. (US) 2005-03-10 WO disclosed
US-20040030126-A1 Process for synthesizing beta-lactam NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2004-02-12 US disclosed
EP-1346981-A1 PROCESS FOR SYNTHESIZING $g(b)-LACTAM National Institute of Advanced Industrial Science and Technology (JP) 2003-09-24 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 (5 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-10238712-B2 Compositions useful for the treatment of gastrointestinal disorders GUCY1A1, TNF, GUCY1A2 ESR1 4831/4885ESR2 4419/4885PAX8 4684/4885
US-20190262420-A1 COMPOSITIONS USEFUL FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS GUCY1A1, TNF, GUCY1A2 ESR1 4831/4885ESR2 4419/4885PAX8 4684/4885
US-20040030126-A1 Process for synthesizing beta-lactam COASY, QPCT, NPEPPS ESR1 4728/4885ESR2 4759/4885PAX8 3836/4885
US-20200113968-A1 AGONISTS OF GUANYLATE CYCLASE USEFUL FOR DOWNREGULATION OF PRO-INFLAMMATORY CYTOKINES GUCY1A1, GUCY1A2, GUCY1B2 ESR1 4435/4885ESR2 2942/4885PAX8 3654/4885
US-20070149776-A1 METHOD FOR PRODUCING 1,4-DIPHENYL AZETIDINONE DERIVATIVES CYP46A1, CYP51A1, APOB ESR1 2945/4885ESR2 1179/4885PAX8 4821/4885

“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.