SCHEMBL21883953

SCHEMBL21883953

CSC(=O)[C@H]1CCCC[C@H]1C(=O)NCCN

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.39
GRM4 Q14833 1/20 0.39
CTSB P07858 3/20 0.38
CTSS P25774 3/20 0.38
CTSK P43235 3/20 0.38
HSD17B10 Q99714 2/20 0.37
ALDH1A1 P00352 1/20 0.37
CASP1 P29466 1/20 0.37
MC4R P32245 1/20 0.36
NAAA Q02083 1/20 0.34

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
SCHEMBL13818150 0.86 TAAR1 (0.47) TAAR1GRM4CTSBCTSSCTSK
SCHEMBL17970596 0.81 TAAR1 (0.42) TAAR1GRM4CTSBCTSSCTSK
SCHEMBL18588463 0.81 TAAR1 (0.42) TAAR1GRM4CTSBCTSSCTSK
SCHEMBL14159195 0.80 TAAR1 (0.58) TAAR1HSD17B10ALDH1A1CASP1MC4R
SCHEMBL4598374 0.80 GRM4 (0.44) TAAR1GRM4CTSBCTSSCTSK
SCHEMBL4824953 0.80 GRM4 (0.44) TAAR1GRM4CTSBCTSSCTSK
SCHEMBL26506434 0.79 GRM4 (0.43) TAAR1GRM4CTSBCTSSCTSK
SCHEMBL25139931 0.77 TAAR1 (0.39) TAAR1GRM4CTSBCTSSCTSK
SCHEMBL21883928 0.77 TAAR1 (0.40) TAAR1GRM4CTSBCTSSCTSK
SCHEMBL18588462 0.77 TAAR1 (0.39) TAAR1GRM4CTSBCTSSCTSK

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-2020053815-A1 RELEASABLE GLP-1 CONJUGATES QUIAPEG PHARMACEUTICALS AB (SE) 2020-03-19 WO disclosed