SCHEMBL4094971

SCHEMBL4094971

C[S+]([O-])c1ccc2oc(/C=C/C3CCN(C(=O)OC(C)(C)C)CC3)cc2c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 15/20 0.41
MMP13 P45452 1/20 0.38
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
PTPN2 P17706 1/20 0.36
PTPN1 P18031 1/20 0.36
PTPN6 P29350 1/20 0.36

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
SCHEMBL4094973 1.00 GPR119 (0.41) GPR119MMP13KDM4EMAPTTHRB
SCHEMBL4096502 0.84 GPR119 (0.49) GPR119MMP13KDM4EMAPTTHRB
SCHEMBL4096500 0.84 GPR119 (0.49) GPR119MMP13KDM4EMAPTTHRB
SCHEMBL4168857 0.80 GPR119 (0.49) GPR119
SCHEMBL4168862 0.80 GPR119 (0.49) GPR119
SCHEMBL4104864 0.79 GPR119 (0.44) GPR119KDM4E
SCHEMBL4166576 0.78 GPR119 (0.52) GPR119
SCHEMBL4166579 0.78 GPR119 (0.52) GPR119
SCHEMBL4094850 0.78 GPR119 (0.46) GPR119MMP13KDM4E
SCHEMBL4094884 0.76 GPR119 (0.42) GPR119KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090221644-A1 Gpcr Agonists PROSIDION LIMITED (GB) 2009-09-03 US disclosed
US-20090221644-A1 Gpcr Agonists PROSIDION LIMITED (GB) 2009-09-03 US disclosed
US-20090221644-A1 Gpcr Agonists PROSIDION LIMITED (GB) 2009-09-03 US disclosed
WO-2007003961-A2 GPCR AGONISTS PROSIDION LIMITED (GB) 2007-01-11 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 (1 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-20090221644-A1 Gpcr Agonists GPR119, GCGR, GPR27 GPR119 1/4885MMP13 4024/4885KDM4E 3925/4885

“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.