SCHEMBL12106827

SCHEMBL12106827

Cc1cc(OCC[C@@H](C)C2CCN(Cl)CC2)ccc1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ THRB P10828 2/20 0.39
▸ THRA P10827 1/20 0.39
▸ ACACB O00763 1/20 0.38
▸ S1PR1 P21453 1/20 0.38
▸ S1PR5 Q9H228 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ PPARD Q03181 1/20 0.37
▸ PPARG P37231 1/20 0.37
▸ PPARA Q07869 1/20 0.37
▸ LMNA P02545 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
SCHEMBL12106833 0.85 THRB (0.42) MAPK1NPSR1THRBTHRAS1PR1
SCHEMBL27810440 0.84 MAPK1 (0.41) MAPK1THRBTHRAPPARD
SCHEMBL12103606 0.84 MAPK1 (0.41) MAPK1THRBTHRAPPARD
SCHEMBL1296820 0.84 GPR119 (0.44) HRH3ACACB
SCHEMBL1296817 0.84 GPR119 (0.44) HRH3ACACB
SCHEMBL1296357 0.84 GPR119 (0.48) MAPK1NPSR1KDM4E
Hydrochloric Acid SCHEMBL1295995 0.83 MAPK1 (0.40) MAPK1THRBTHRAPPARD
Hydrochloric Acid SCHEMBL1295997 0.83 MAPK1 (0.40) MAPK1THRBTHRAPPARD
SCHEMBL1296246 0.82 GPR119 (0.45) ACACB
SCHEMBL1296250 0.82 GPR119 (0.45) ACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269734-A1 PIPERIDINYL GPCR AGONISTS PROSIDION LIMITED (GB) 2011-11-03 — — US disclosed
WO-2010004343-A1 PIPERIDINYL 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-20110269734-A1 PIPERIDINYL GPCR AGONISTS GPR119, GPR27, GLP1R MAPK1 793/4885HRH3 494/4885NPSR1 68/4885

“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.

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