SCHEMBL19406603

SCHEMBL19406603

O=C(O)[C@@H]1CCC(c2ccccc2Cl)N1C(=O)C1CCN(c2nc3ccccc3o2)CC1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FFAR2 O15552 15/20 0.59
▸ LMNA P02545 4/20 0.48
▸ MAPT P10636 2/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ HTT P42858 2/20 0.48
▸ TSHR P16473 1/20 0.48

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
SCHEMBL2039599 1.00 FFAR2 (0.59) FFAR2LMNAMAPTSMN1; SMN2HTT
SCHEMBL29787736 1.00 FFAR2 (0.59) FFAR2LMNAMAPTSMN1; SMN2HTT
SCHEMBL2039602 1.00 FFAR2 (0.59) FFAR2LMNAMAPTSMN1; SMN2HTT
SCHEMBL23658499 0.81 LMNA (0.53) LMNAMAPTSMN1; SMN2HTTTSHR
SCHEMBL2040215 0.77 LMNA (0.66) LMNAMAPTSMN1; SMN2HTTTSHR
SCHEMBL29787531 0.77 FFAR2 (0.71) FFAR2
SCHEMBL2038056 0.77 FFAR2 (0.71) FFAR2
SCHEMBL29787712 0.76 FFAR2 (0.80) FFAR2
SCHEMBL2037572 0.76 FFAR2 (0.80) FFAR2
SCHEMBL29787855 0.75 FFAR2 (0.75) FFAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2513053-B1 Pyrrolidine carboxylic acid derivatives as agonists of G-protein coupled receptor 43 (GPR43), pharmaceutical composition and methods for use in treating metabolic disorders OGEDA SA (BE) 2017-10-04 — — EP disclosed
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