SCHEMBL2215401

SCHEMBL2215401

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

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.41
ACACB O00763 5/20 0.39
ACACA Q13085 4/20 0.39
HDAC4 P56524 6/20 0.38
HDAC6 Q9UBN7 5/20 0.38
HRH3 Q9Y5N1 2/20 0.37
HDAC1 Q13547 1/20 0.37

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
SCHEMBL2215455 0.96 ACACB (0.44) GPR119ACACBACACAHDAC4HDAC6
SCHEMBL2217202 0.92 HDAC4 (0.42) GPR119ACACBACACAHDAC4HDAC6
SCHEMBL2218219 0.88 HDAC4 (0.42) GPR119ACACBACACAHDAC4HDAC6
SCHEMBL2214951 0.88 GPR119 (0.41) GPR119ACACBACACAHDAC4HDAC6
SCHEMBL2217692 0.87 HDAC4 (0.48) GPR119HDAC4HDAC6HDAC1
SCHEMBL2218683 0.85 GPR119 (0.38) GPR119ACACBACACAHDAC4HDAC6
SCHEMBL2218214 0.85 ACACB (0.41) GPR119ACACBACACAHRH3
SCHEMBL2218651 0.85 ACACB (0.42) GPR119ACACBACACAHRH3
SCHEMBL1842388 0.85 GPR119 (0.42) GPR119ACACBACACAHRH3
SCHEMBL1844407 0.84 ACACB (0.42) GPR119ACACBACACAHRH3

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-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
WO-2010004348-A1 HETEROCYCLIC GPCR AGONISTS PROSIDION LIMITED (GB) 2010-01-14 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-20110178054-A1 Heterocyclic GPCR Agonists GPR119, GCGR, GPR27 GPR119 1/4885ACACB 2654/4885ACACA 2114/4885

“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.