SCHEMBL2214951

SCHEMBL2214951

Cc1cc(OCCCC2CCN(c3noc(C(C)(C)F)n3)CC2)ccc1C(=O)NC(CO)CO

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.41
ACACB O00763 8/20 0.40
ACACA Q13085 6/20 0.40
HRH3 Q9Y5N1 2/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
HDAC4 P56524 3/20 0.35
HDAC6 Q9UBN7 3/20 0.35

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
SCHEMBL2217895 0.96 ACACB (0.44) GPR119ACACBACACAHRH3NPC1
SCHEMBL2217202 0.93 HDAC4 (0.42) GPR119ACACBACACAHRH3HDAC4
SCHEMBL2218219 0.89 HDAC4 (0.42) GPR119ACACBACACAHRH3HDAC4
SCHEMBL2372242 0.89 ACACB (0.42) GPR119ACACBACACAHRH3NPC1
SCHEMBL2215222 0.89 GPR119 (0.40) GPR119ACACBACACAHRH3NPC1
SCHEMBL2215213 0.89 GPR119 (0.40) GPR119ACACBACACAHRH3NPC1
SCHEMBL2217692 0.89 HDAC4 (0.48) GPR119HDAC4HDAC6
SCHEMBL2216040 0.88 GPR119 (0.43) GPR119ACACBACACANPC1RAB9A
SCHEMBL2214642 0.88 GPR119 (0.42) GPR119ACACBACACAHRH3NPC1
SCHEMBL2215401 0.88 GPR119 (0.41) GPR119ACACBACACAHRH3HDAC4

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 1/4885ACACB 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.