SCHEMBL30645355

SCHEMBL30645355

CC1c2ccc(O)cc2CCN1C(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 6/20 0.56
ESR1 P03372 5/20 0.47
NR1H2 P55055 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GHSR Q92847 10/20 0.43
DRD1 P21728 2/20 0.42
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD5 P21918 1/20 0.40
DRD3 P35462 1/20 0.40

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
SCHEMBL31505408 1.00 ESR2 (0.56) ESR2ESR1NR1H2SMN1; SMN2GHSR
SCHEMBL31505338 1.00 ESR2 (0.56) ESR2ESR1NR1H2SMN1; SMN2GHSR
SCHEMBL24528817 1.00 ESR2 (0.56) ESR2ESR1NR1H2SMN1; SMN2GHSR
SCHEMBL31505332 1.00 ESR2 (0.56) ESR2ESR1NR1H2SMN1; SMN2GHSR
SCHEMBL21470624 0.90 ESR2 (0.56) ESR2ESR1NR1H2SMN1; SMN2GHSR
SCHEMBL21470623 0.90 ESR2 (0.56) ESR2ESR1NR1H2SMN1; SMN2GHSR
SCHEMBL18617672 0.87 LMNA (0.45) ESR2NR1H2SMN1; SMN2GHSR
SCHEMBL4183874 0.86 NR1H2 (0.60) ESR2NR1H2SMN1; SMN2GHSRDRD1
SCHEMBL12280043 0.86 NR1H2 (0.43) ESR2ESR1NR1H2SMN1; SMN2GHSR
SCHEMBL29676621 0.86 NR1H2 (0.43) ESR2ESR1NR1H2SMN1; SMN2GHSR

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
CN-116897150-A Novel bifunctional molecules for protein-targeted degradation 安菲斯塔治疗有限公司 2023-10-17 CN disclosed