SCHEMBL29835129

SCHEMBL29835129

Cc1cc2c(cc1Cl)CN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NR1H2 P55055 2/20 0.49
HDAC1 Q13547 1/20 0.47
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
MAPK1 P28482 1/20 0.43
NAMPT P43490 2/20 0.40
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
STS P08842 3/20 0.38
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GPR119 Q8TDV5 1/20 0.38

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
SCHEMBL3882527 1.00 ESR2 (0.50) ESR2MEN1KMT2ANR1H2HDAC1
SCHEMBL3872743 0.84 ESR2 (0.49) ESR2MEN1KMT2ANR1H2HDAC1
SCHEMBL29835127 0.84 ESR2 (0.49) ESR2MEN1KMT2ANR1H2HDAC1
SCHEMBL3874348 0.82 ABHD6 (0.50) ESR2NR1H2HDAC1DDB1CRBN
SCHEMBL17898122 0.81 NR1H2 (0.48) ESR2MEN1KMT2ANR1H2HDAC1
SCHEMBL3878152 0.80 ESR2 (0.49) ESR2MEN1KMT2ANR1H2HDAC1
SCHEMBL15503196 0.79 NR1H2 (0.47) ESR2MEN1KMT2ANR1H2HDAC1
SCHEMBL3873647 0.79 ESR2 (0.48) ESR2MEN1KMT2ANR1H2HDAC1
SCHEMBL3878070 0.79 ESR2 (0.45) ESR2MEN1KMT2ANR1H2HDAC1
SCHEMBL8223384 0.79 ESR2 (0.60) ESR2MEN1KMT2ANR1H2HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115052596-B ADAMTS inhibitor, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2024-06-14 CN disclosed
CN-115052596-A ADAMTS inhibitor, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2022-09-13 CN disclosed