SCHEMBL2217954

SCHEMBL2217954

Cc1cc(OCCCC2CCN(c3noc(C(C)(C)F)n3)CC2)ccc1C(=O)N[C@H]1CCC[C@@H]1O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.44
HDAC4 P56524 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
ACACB O00763 3/20 0.37
ACACA Q13085 3/20 0.37
CHRM1 P11229 2/20 0.36
KCNH2 Q12809 2/20 0.36
TTK P33981 1/20 0.35
GABRA5 P31644 2/20 0.35
CNR2 P34972 1/20 0.34
CNR1 P21554 1/20 0.34
SCN9A Q15858 1/20 0.34
HCRTR1 O43613 1/20 0.34

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
SCHEMBL2216930 1.00 GPR119 (0.44) GPR119HDAC4HDAC6ACACBACACA
SCHEMBL2219780 0.96 GPR119 (0.44) GPR119HDAC4HDAC6ACACBACACA
SCHEMBL2217755 0.96 GPR119 (0.44) GPR119HDAC4HDAC6ACACBACACA
SCHEMBL2215240 0.91 GPR119 (0.42) GPR119ACACBACACACHRM1KCNH2
SCHEMBL2219251 0.91 GPR119 (0.42) GPR119ACACBACACACHRM1KCNH2
SCHEMBL2219840 0.87 GPR119 (0.42) GPR119ACACBACACAKCNH2TTK
SCHEMBL2216070 0.87 GPR119 (0.42) GPR119ACACBACACAKCNH2TTK
SCHEMBL1842388 0.85 GPR119 (0.42) GPR119ACACBACACA
SCHEMBL1844407 0.85 ACACB (0.42) GPR119ACACBACACA
SCHEMBL2216040 0.85 GPR119 (0.43) GPR119HDAC4HDAC6ACACBACACA

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-20110178054-A1 Heterocyclic GPCR Agonists PROSIDION LIMITED (GB) 2011-07-21 US disclosed
US-20110178054-A1 Heterocyclic GPCR Agonists PROSIDION LIMITED (GB) 2011-07-21 US disclosed
US-20110178054-A1 Heterocyclic GPCR Agonists PROSIDION LIMITED (GB) 2011-07-21 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 (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-20110178054-A1 Heterocyclic GPCR Agonists GPR119, GCGR, GPR27 GPR119 1/4885HDAC4 2047/4885HDAC6 1981/4885

“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.