Sugi Predict

Sugi Predict / Compounds / SCHEMBL29945870

SCHEMBL29945870

SCHEMBL29945870

CC(C)(C)OC(=O)N1CCC(c2ccn(OCc3ccc(F)cc3F)n2)CC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ GPR119 Q8TDV5 1/20 0.45
▸ DPP4 P27487 1/20 0.44
▸ TRPV3 Q8NET8 1/20 0.43
▸ MAPT P10636 4/20 0.42
▸ TP53 P04637 3/20 0.42
▸ LMNA P02545 4/20 0.42
▸ THRB P10828 1/20 0.42

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
SCHEMBL29945924 0.91 TRPV3 (0.44) SMN1; SMN2DPP4TRPV3MAPTTP53
SCHEMBL29945852 0.89 GPR119 (0.53) SMN1; SMN2GPR119DPP4TRPV3MAPT
SCHEMBL29945937 0.87 SMN1; SMN2 (0.38) SMN1; SMN2GPR119DPP4MAPTTP53
SCHEMBL29945994 0.87 GPR119 (0.46) SMN1; SMN2GPR119TRPV3TP53LMNA
SCHEMBL29946020 0.79 MEN1 (0.48) SMN1; SMN2GPR119TP53LMNATHRB
SCHEMBL29946017 0.79 MEN1 (0.48) SMN1; SMN2GPR119TP53LMNATHRB
SCHEMBL24485767 0.79 GLP1R (0.56) SMN1; SMN2TRPV3
SCHEMBL29668702 0.79 GLP1R (0.56) SMN1; SMN2TRPV3
SCHEMBL13060199 0.78 DPP4 (0.52) SMN1; SMN2GPR119DPP4
SCHEMBL29946162 0.77 HTR6 (0.49) —

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
WO-2022184849-A1 GLP-1R AGONISTS, USES AND PHARMACEUTICAL COMPOSITIONS THEREOF LES LABORATOIRES SERVIER (FR) 2022-09-09 — — WO disclosed