SCHEMBL30771987

SCHEMBL30771987

C[C@H](NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](N)C(C)(C)C)c1ccc(-c2ccccc2F)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
VHL P40337 15/20 0.51
ELOC Q15369 5/20 0.46
ELOB Q15370 5/20 0.46
DPP4 P27487 3/20 0.42
DPP7 Q9UHL4 1/20 0.42
DPP8 Q6V1X1 2/20 0.39
DPP9 Q86TI2 2/20 0.39
PDE2A O00408 1/20 0.39
KIF11 P52732 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL30771993 1.00 VHL (0.51) VHLELOCELOBDPP4DPP7
SCHEMBL30772055 1.00 VHL (0.51) VHLELOCELOBDPP4DPP7
SCHEMBL24756796 0.90 VHL (0.46) VHLELOCELOBDPP4DPP8
SCHEMBL24757855 0.90 VHL (0.52) VHLELOCELOBDPP4DPP7
SCHEMBL30149065 0.90 VHL (0.52) VHLELOCELOBDPP4DPP7
SCHEMBL27359569 0.90 VHL (0.44) VHLELOCELOBDPP4DPP7
SCHEMBL30148979 0.89 VHL (0.51) VHLELOCELOBDPP4DPP7
SCHEMBL24757713 0.89 VHL (0.51) VHLELOCELOBDPP4DPP8
SCHEMBL25166784 0.87 VHL (0.52) VHLELOCELOBDPP4DPP8
SCHEMBL25166783 0.87 VHL (0.52) VHLELOCELOBDPP4DPP8

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-2024001839-A1 HETEROAROMATIC RING COMPOUND, METHOD FOR PREPARING SAME, AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2024-01-04 WO disclosed