SCHEMBL25154653

SCHEMBL25154653

CC(=O)N1C[C@@H](C)N(C(C)=O)C[C@@H]1CC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
ABCB1 P08183 3/20 0.39
TSHR P16473 2/20 0.38
MAPT P10636 1/20 0.38
GAA P10253 1/20 0.36
ATM Q13315 1/20 0.34
ITGB1 P05556 1/20 0.31
ITGA5 P08648 1/20 0.31
FFAR1 O14842 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL25154755 1.00 SMN1; SMN2 (0.39) SMN1; SMN2ABCB1TSHRMAPTGAA
SCHEMBL25154467 1.00 SMN1; SMN2 (0.39) SMN1; SMN2ABCB1TSHRMAPTGAA
SCHEMBL25154405 1.00 SMN1; SMN2 (0.39) SMN1; SMN2ABCB1TSHRMAPTGAA
SCHEMBL25154325 0.86 ABCB1 (0.34) SMN1; SMN2ABCB1TSHRMAPTGAA
SCHEMBL25154386 0.86 ABCB1 (0.34) SMN1; SMN2ABCB1TSHRMAPTGAA
SCHEMBL25154747 0.86 ABCB1 (0.34) SMN1; SMN2ABCB1TSHRMAPTGAA
SCHEMBL25154347 0.86 ABCB1 (0.34) SMN1; SMN2ABCB1TSHRMAPTGAA
SCHEMBL25154479 0.86 ABCB1 (0.34) SMN1; SMN2ABCB1TSHRMAPTGAA
SCHEMBL25154640 0.86 ABCB1 (0.34) SMN1; SMN2ABCB1TSHRMAPTGAA
SCHEMBL25154639 0.86 ABCB1 (0.34) SMN1; SMN2ABCB1TSHRMAPTGAA

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-2023064768-A1 G-PROTEIN-COUPLED RECEPTOR REGULATORS AND METHODS OF USE THEREOF BAYLOR COLLEGE OF MEDICINE (US) 2023-04-20 WO disclosed