SCHEMBL29912864

SCHEMBL29912864

CC1CCN(C(=O)OC(C)(C)C)CC1COc1cccnc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 8/20 0.47
▸ RBP4 P02753 1/20 0.47
▸ SSTR4 P31391 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ USP30 Q70CQ3 2/20 0.41
▸ ALOX5AP P20292 1/20 0.41
▸ FEN1 P39748 1/20 0.41
▸ JAK2 O60674 1/20 0.40
▸ JAK1 P23458 1/20 0.40

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
SCHEMBL27158392 1.00 GPR119 (0.47) GPR119RBP4SSTR4POLBMEN1
SCHEMBL27157819 0.90 RBP4 (0.47) GPR119RBP4SSTR4POLBUSP30
SCHEMBL29912926 0.90 RBP4 (0.47) GPR119RBP4SSTR4POLBUSP30
SCHEMBL27158623 0.86 RBP4 (0.54) GPR119RBP4SSTR4POLBALOX5AP
SCHEMBL30785509 0.86 RBP4 (0.54) GPR119RBP4SSTR4POLBALOX5AP
SCHEMBL30785481 0.84 RBP4 (0.53) GPR119RBP4SSTR4ALOX5APFEN1
SCHEMBL30785499 0.84 RBP4 (0.53) GPR119RBP4SSTR4ALOX5APFEN1
SCHEMBL27157998 0.84 RBP4 (0.53) GPR119RBP4SSTR4ALOX5APFEN1
SCHEMBL29202348 0.84 RBP4 (0.53) GPR119RBP4SSTR4ALOX5APFEN1
SCHEMBL29913084 0.82 SSTR4 (0.48) GPR119RBP4SSTR4POLBALOX5AP

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
EP-4329881-A1 SMALL MOLECULE MODULATORS OF GLUCOCEREBROSIDASE ACTIVITY AND USES THEREOF Vanqua Bio, Inc. (US) 2024-03-06 — — EP disclosed
CN-117642404-A Small molecule modulators of glucocerebrosidase activity and uses thereof 凡况生化公司 2024-03-01 — — CN disclosed
WO-2022232383-A1 SMALL MOLECULE MODULATORS OF GLUCOCEREBROSIDASE ACTIVITY AND USES THEREOF VANQUA BIO, INC. (US) 2022-11-03 — — WO disclosed
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