SCHEMBL30858342

SCHEMBL30858342

COC(=O)c1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)c(F)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.57
MAPT P10636 6/20 0.56
KMT2A Q03164 4/20 0.54
MEN1 O00255 3/20 0.54
ALDH1A1 P00352 5/20 0.53
LMNA P02545 4/20 0.53
HPGD P15428 3/20 0.53
NPC1 O15118 3/20 0.53
NPSR1 Q6W5P4 3/20 0.53
ALOX15 P16050 1/20 0.53
TSHR P16473 1/20 0.53
MAPK1 P28482 1/20 0.53
HSD17B10 Q99714 1/20 0.53
KDM4E B2RXH2 2/20 0.53
USP30 Q70CQ3 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.47

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
SCHEMBL354815 1.00 L3MBTL1 (0.57) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL30796039 0.93 L3MBTL1 (0.59) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL30014462 0.90 ALDH1A1 (0.50) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL25901418 0.88 HDAC2 (0.46) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL8251175 0.88 L3MBTL1 (0.73) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL30858329 0.88 L3MBTL1 (0.59) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL354715 0.88 L3MBTL1 (0.59) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL27202624 0.87 L3MBTL1 (0.56) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL354114 0.86 L3MBTL1 (0.58) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL30414220 0.86 LMNA (0.49) MAPTKMT2AMEN1ALDH1A1LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025108404-A1 HETEROCYCLIC COMPOUND OF BIFUNCTIONAL CHIMERA FOR TARGETED DEGRADATION OF ANDROGEN RECEPTOR AND USE THEREOF 广东东阳光药业股份有限公司 2025-05-30 WO disclosed
WO-2024178127-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF 1CBIO, INC. (US) 2024-08-29 WO disclosed
WO-2024178125-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF 1CBIO, INC. (US) 2024-08-29 WO disclosed
WO-2024050370-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF 1CBIO, INC. (US) 2024-03-07 WO disclosed