SCHEMBL2731334

SCHEMBL2731334

OCC(CO)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 2/20 0.68
PRKCD Q05655 2/20 0.68
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
LTA4H P09960 1/20 0.56
EPHX2 P34913 1/20 0.56
MAOB P27338 4/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
MAOA P21397 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55

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
SCHEMBL5852441 0.84 LMNA (0.59) PRKCAPRKCDLMNACYP1A2PTGS1
SCHEMBL8440300 0.83 BCHE (0.58) PRKCAPRKCDLMNACYP1A2PTGS1
SCHEMBL322827 0.83 LMNA (0.58) PRKCAPRKCDLMNACYP1A2PTGS1
SCHEMBL6568552 0.83 LMNA (0.58) PRKCAPRKCDLMNACYP1A2PTGS1
SCHEMBL8616667 0.83 PRKCA (0.54) PRKCAPRKCDLMNACYP1A2PTGS1
SCHEMBL17386272 0.83 PRKCA (0.64) PRKCAPRKCDMAOBRAB9ASMN1; SMN2
SCHEMBL17386273 0.83 PRKCA (0.64) PRKCAPRKCDMAOBRAB9ASMN1; SMN2
SCHEMBL11074823 0.82 MAOB (0.61) PRKCAPRKCDLMNACYP1A2PTGS1
SCHEMBL11606393 0.81 LMNA (0.66) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL8761083 0.81 LMNA (0.66) LMNACYP1A2PTGS1SLC6A2CYP2C19

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8772302-B2 GPR 119 agonists CADILA HEALTHCARE LIMITED (IN) 2014-07-08 US disclosed
EP-2445904-B1 1,3,2-DIOXATHIANE-2-OXIDE DERIVATIVES AND THEIR USE AS GPR 119 AGONISTS CADILA HEALTHCARE LTD (IN) 2013-09-11 EP disclosed
US-20120122905-A1 NOVEL GPR 119 AGONISTS CADILA HEALTHCARE LIMITED (IN) 2012-05-17 US disclosed
EP-2445904-A1 NOVEL GPR 119 AGONISTS Cadila Healthcare Limited (IN) 2012-05-02 EP disclosed
WO-2010146605-A1 NOVEL GPR 119 AGONISTS CADILA HEALTHCARE LIMITED (IN) 2010-12-23 WO disclosed
US-20090012069-A1 Novel Antidiabetic Compounds CADILA HEALTHCARE LIMITED (IN) 2009-01-08 US disclosed
EP-1781633-A1 NOVEL ANTIDIABETIC COMPOUNDS CADILA HEALTHCARE LIMITED (IN) 2007-05-09 EP disclosed
WO-2006018855-A1 NOVEL ANTIDIABETIC COMPOUNDS CADILA HEALTHCARE LIMITED (IN) 2006-02-23 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 (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-20090012069-A1 Novel Antidiabetic Compounds GPR119, SLC5A1, SLC5A2 PRKCA 1472/4885PRKCD 1855/4885LMNA 2372/4885
US-20120122905-A1 NOVEL GPR 119 AGONISTS GPR119, GPR4, GPR39 PRKCA 1276/4885PRKCD 1093/4885LMNA 4491/4885

“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.