SCHEMBL2216772

SCHEMBL2216772

Cc1cc(OCCCC2CCN(c3nc(C(C)(F)F)no3)CC2)ccc1C(=O)NC(CO)CO

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.38
HRH3 Q9Y5N1 7/20 0.37
KCNH2 Q12809 1/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ACACB O00763 1/20 0.34
PPARG P37231 1/20 0.34
PPARD Q03181 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
SCHEMBL2216789 0.89 GPR119 (0.41) GPR119HRH3KCNH2NPC1RAB9A
SCHEMBL2372270 0.88 GPR119 (0.37) GPR119HRH3KCNH2NPC1RAB9A
SCHEMBL2370849 0.88 GPR119 (0.48) GPR119HRH3KCNH2NPC1RAB9A
SCHEMBL2220450 0.88 GPR119 (0.37) GPR119HRH3KCNH2NPC1RAB9A
SCHEMBL1842843 0.87 GPR119 (0.39) GPR119KCNH2NPC1RAB9APPARG
SCHEMBL1846787 0.87 GPR119 (0.39) GPR119KCNH2NPC1RAB9APPARG
SCHEMBL2372246 0.87 GPR119 (0.38) GPR119HRH3KCNH2NPC1RAB9A
SCHEMBL2217447 0.86 GPR119 (0.40) GPR119HRH3KCNH2NPC1RAB9A
SCHEMBL2216360 0.86 GPR119 (0.41) GPR119HRH3KCNH2NPC1RAB9A
SCHEMBL2217895 0.86 ACACB (0.44) GPR119HRH3NPC1RAB9AACACB

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 1/4885HRH3 406/4885KCNH2 1332/4885

“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.