SCHEMBL970562

SCHEMBL970562

CC(C)(C)OC(=O)N1CCC(Sc2cn[c]s2)CC1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.46
HPGD P15428 1/20 0.45
RECQL P46063 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
PTPN2 P17706 1/20 0.43
PTPN1 P18031 1/20 0.43
PTPN6 P29350 1/20 0.43
ALDH1A1 P00352 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
SCHEMBL2666840 0.78 GPR119 (0.46) GPR119HPGDRECQLKDM4EMAPT
SCHEMBL4772966 0.76 GPR119 (0.52) GPR119KDM4EMAPTPTPN2PTPN1
SCHEMBL4777861 0.74 GPR119 (0.69) GPR119HPGDKDM4EMAPTTHRB
SCHEMBL4777234 0.73 GPR119 (0.55) GPR119PTPN2PTPN1PTPN6
SCHEMBL4768579 0.72 GPR119 (0.62) GPR119HPGDRECQL
SCHEMBL1181631 0.72 GPR119 (0.54) GPR119HPGDKDM4EMAPTTHRB
SCHEMBL3128872 0.72 GPR119 (0.61) GPR119KDM4ETHRBPTPN2PTPN1
SCHEMBL18340953 0.71 HPGD (0.58) GPR119HPGDRECQLKDM4EMAPT
SCHEMBL22759260 0.71 GPR119 (0.62) GPR119MAPTPTPN2PTPN1PTPN6
SCHEMBL1532538 0.71 GPR119 (0.55) GPR119HPGDKDM4EMAPTTHRB

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-8258134-B2 Pyridazinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2012-09-04 US disclosed
US-8178689-B2 Tricyclic compounds HOFFMAN-LA ROCHE INC. (US) 2012-05-15 US disclosed
EP-2274297-B1 PYRROLIDINONE GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2012-05-09 EP disclosed
US-20110313002-A1 TRICYCLIC COMPOUNDS SARABU RAMAKANTH (US) 2011-12-22 US disclosed
US-20110021570-A1 PYRIDONE GLUCOKINASE ACTIVATORS HAYNES NANCY-ELLEN 2011-01-27 US disclosed
US-7741327-B2 Pyrrolidinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2010-06-22 US disclosed
US-20090264445-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 US disclosed
US-20090264434-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 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 (4 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-20090264445-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS GCKR, GCK, PDK2 GPR119 33/4885HPGD 472/4885RECQL 3396/4885
US-20110021570-A1 PYRIDONE GLUCOKINASE ACTIVATORS GCK, PDXK, G6PD GPR119 39/4885HPGD 354/4885RECQL 1036/4885
US-20090264434-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS GCK, GCKR, PDXK GPR119 35/4885HPGD 597/4885RECQL 1502/4885
US-20110313002-A1 TRICYCLIC COMPOUNDS GPR119, PC, GOT2 GPR119 1/4885HPGD 840/4885RECQL 2349/4885

“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.