SCHEMBL4466569

SCHEMBL4466569

CC(C)(C)OC(=O)N1CCC(c2nccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)n2)CC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.50
SYK P43405 2/20 0.49
STS P08842 1/20 0.48
P2RY14 Q15391 1/20 0.48
HTT P42858 1/20 0.46
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL4451814 0.84 STS (0.50) GPR119SYKSTSP2RY14HTT
SCHEMBL6629645 0.83 HTT (0.52) GPR119HTTKDM4EMAPT
SCHEMBL13807221 0.81 STS (0.49) GPR119STSP2RY14HTTKDM4E
SCHEMBL25121090 0.78 GPR119 (0.51) GPR119KDM4EMAPTTHRB
SCHEMBL25719736 0.78 GPR119 (0.51) GPR119KDM4EMAPTTHRB
SCHEMBL13959341 0.78 CCR2 (0.38)
SCHEMBL13807225 0.77 STS (0.48) GPR119SYKSTSP2RY14HTT
SCHEMBL24962316 0.77 GPR119 (0.55) GPR119STSP2RY14KDM4EMAPT
SCHEMBL4451823 0.77 GRM1 (0.49)
SCHEMBL10324281 0.76 GPR119 (0.49) GPR119KDM4EMAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090030012-A1 Pyridine, Pyrimidine and Pyrazine Derivatives as Cxcr3 Receptor Modulators MERCK SHARP & DOHME CORP. 2009-01-29 US disclosed
US-20090030012-A1 Pyridine, Pyrimidine and Pyrazine Derivatives as Cxcr3 Receptor Modulators MERCK SHARP & DOHME CORP. 2009-01-29 US disclosed
WO-2007100610-A2 PYRIDINE, PYRIMIDINE AND PYRAZINE DERIVATIVES AS CXCR3 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2007-09-07 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-20090030012-A1 Pyridine, Pyrimidine and Pyrazine Derivatives as Cxcr3 Receptor Modulators CXCR3, CXCR1, CXCR5 GPR119 185/4885SYK 1052/4885STS 2670/4885

“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.