SCHEMBL30936775

SCHEMBL30936775

CC(C)(C)C1CC(OCCOCc2ccccc2)CCN1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 5/20 0.49
LIPG Q9Y5X9 1/20 0.46
TEAD3 Q99594 2/20 0.40
BCHE P06276 2/20 0.39
TMEM97 Q5BJF2 2/20 0.38
SIGMAR1 Q99720 2/20 0.38
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
EPHX2 P34913 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CHRM3 P20309 1/20 0.36
FKBP1A P62942 1/20 0.36

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
SCHEMBL29061084 0.99 AGTR2 (0.48) AGTR2LIPGTEAD3BCHETMEM97
SCHEMBL30937049 0.94 AGTR2 (0.50) AGTR2LIPGTEAD3BCHETMEM97
SCHEMBL21070250 0.78 LIPG (0.35) AGTR2LIPG
SCHEMBL22284346 0.78 AGTR2 (0.38) AGTR2LIPGTEAD3MEN1GAA
SCHEMBL7400688 0.77 AGTR2 (0.46) AGTR2TMEM97SIGMAR1
SCHEMBL26634961 0.77 SMN1; SMN2 (0.46) AGTR2MEN1KMT2A
SCHEMBL28516435 0.76 LIPG (0.34) AGTR2LIPGKMT2A
SCHEMBL21997606 0.76 AGTR2 (0.38) AGTR2LIPGMEN1KMT2A
SCHEMBL21458588 0.76 LIPG (0.34) LIPGKMT2AEPHX2
SCHEMBL21458596 0.75 STS (0.53) LIPGGAA

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-2024072178-A1 COMPOUND FOR TARGETED PROTEIN DEGRADATION, AND USE THEREOF (주)사이러스테라퓨틱스 2024-04-04 WO disclosed