SCHEMBL6832477

SCHEMBL6832477

CC1CC(=O)N2CCN(C(=O)OC(C)(C)C)CC12Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.42
STS P08842 1/20 0.42
ACHE P22303 1/20 0.42
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
USP30 Q70CQ3 1/20 0.40
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
GAA P10253 1/20 0.39
THRB P10828 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DTYMK P23919 1/20 0.39

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
SCHEMBL6832476 1.00 GPR119 (0.42) GPR119STSACHEPDE4APDE4B
SCHEMBL5231428 0.78 STS (0.44) GPR119STSACHEJAK2JAK1
SCHEMBL5231431 0.78 STS (0.44) GPR119STSACHEJAK2JAK1
SCHEMBL5230321 0.77 ACHE (0.42) GPR119STSACHEJAK2JAK1
SCHEMBL5232478 0.75 GPR119 (0.43) GPR119STSACHEJAK2JAK1
SCHEMBL5225116 0.75 GPR119 (0.43) GPR119ACHEUSP30KDM4ETHRB
SCHEMBL5232846 0.74 ACHE (0.44) GPR119STSACHEJAK2JAK1
SCHEMBL2858192 0.74 ACHE (0.42) GPR119STSACHEJAK2JAK1
SCHEMBL6699145 0.74 ACHE (0.42) GPR119STSACHEJAK2JAK1
SCHEMBL5228526 0.74 ACHE (0.44) GPR119STSACHEJAK2JAK1

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-RE38524-E1 Dipeptide derivatives as growth hormone secretagogues PFIZER INC. 2004-06-01 US disclosed
US-6251902-B1 Dipeptide derivatives as growth hormone secretagogues PFIZER INC. 2001-06-26 US disclosed