SCHEMBL29974005

SCHEMBL29974005

CC(C)(C)OC(=O)N1Cc2ccc(CO)cc2C1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.54
HDAC1 Q13547 1/20 0.54
NR1H2 P55055 1/20 0.53
DDB1 Q16531 1/20 0.50
CRBN Q96SW2 1/20 0.50
NAMPT P43490 13/20 0.48
GPR119 Q8TDV5 1/20 0.45
MAPK1 P28482 1/20 0.44
PIK3CA P42336 1/20 0.41
MTOR P42345 1/20 0.41

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
SCHEMBL1650190 1.00 ESR2 (0.54) ESR2HDAC1NR1H2DDB1CRBN
SCHEMBL29407529 0.89 ESR2 (0.70) ESR2HDAC1NR1H2DDB1CRBN
SCHEMBL29407557 0.89 NR1H2 (0.69) ESR2HDAC1NR1H2DDB1CRBN
SCHEMBL1285596 0.89 NR1H2 (0.69) ESR2HDAC1NR1H2DDB1CRBN
SCHEMBL168265 0.89 ESR2 (0.70) ESR2HDAC1NR1H2DDB1CRBN
SCHEMBL4050983 0.89 ESR2 (0.52) ESR2HDAC1NR1H2DDB1CRBN
SCHEMBL18379840 0.87 ESR2 (0.53) ESR2HDAC1NR1H2DDB1CRBN
SCHEMBL8921662 0.87 NR1H2 (0.55) ESR2HDAC1NR1H2DDB1CRBN
SCHEMBL30895660 0.87 ESR2 (0.53) ESR2HDAC1NR1H2DDB1CRBN
SCHEMBL18883051 0.87 ESR2 (0.53) ESR2HDAC1NR1H2DDB1CRBN

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
CN-115397811-B Isoindoline derivatives binding to ATP binding sites 奈奥芬莱有限公司 2025-05-23 CN disclosed
CN-118317954-A Indoline as PROTAC compound 奈奥芬莱有限公司 2024-07-09 CN disclosed
CN-117693507-A Inhibitor compounds 奈奥芬莱有限公司 2024-03-12 CN disclosed
CN-115397811-A Isoindoline derivatives that bind to ATP binding sites 奈奥芬莱有限公司 2022-11-25 CN disclosed