SCHEMBL24816784

SCHEMBL24816784

CC(C)(C)OC(=O)N1Cc2cc(O)c(F)cc2C1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.50
NR1H2 P55055 2/20 0.49
HDAC1 Q13547 1/20 0.47
DDB1 Q16531 2/20 0.44
CRBN Q96SW2 2/20 0.44
MAPK1 P28482 1/20 0.43
DPP4 P27487 1/20 0.40
ABHD6 Q9BV23 3/20 0.40
NAMPT P43490 3/20 0.40
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
USP30 Q70CQ3 1/20 0.38
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL30260152 0.90 ESR2 (0.64) ESR2NR1H2HDAC1DDB1CRBN
SCHEMBL21470912 0.90 ESR2 (0.64) ESR2NR1H2HDAC1DDB1CRBN
SCHEMBL30199587 0.90 ESR2 (0.64) ESR2NR1H2HDAC1DDB1CRBN
SCHEMBL23684302 0.90 ESR2 (0.64) ESR2NR1H2HDAC1DDB1CRBN
SCHEMBL17221201 0.84 HDAC1 (0.49) ESR2NR1H2HDAC1DDB1CRBN
SCHEMBL3876257 0.84 NR1H2 (0.48) ESR2NR1H2HDAC1DDB1CRBN
SCHEMBL23727707 0.82 NR1H2 (0.47) ESR2NR1H2HDAC1DDB1CRBN
SCHEMBL29835115 0.82 NR1H2 (0.47) ESR2NR1H2HDAC1DDB1CRBN
SCHEMBL21470913 0.82 ESR2 (0.43) ESR2NR1H2HDAC1DDB1CRBN
SCHEMBL23727210 0.81 HDAC1 (0.47) ESR2NR1H2HDAC1DDB1CRBN

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-2022268229-A1 PROTEIN INHIBITOR OR DEGRADING AGENT, PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PHARMACEUTICAL USE 和径医药科技(上海)有限公司 2022-12-29 WO disclosed