SCHEMBL30809287

SCHEMBL30809287

CC(C)(C)OC(=O)N1CC2(CC2)c2cnc(Cl)cc21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.40
KDM1A O60341 1/20 0.37
XIAP P98170 2/20 0.37
BIRC2 Q13490 2/20 0.37
NR1H2 P55055 2/20 0.36
ESR2 Q92731 1/20 0.35
HDAC1 Q13547 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
HDAC8 Q9BY41 1/20 0.34
POLB P06746 1/20 0.33
CYP11B2 P19099 1/20 0.33
SCD5 Q86SK9 1/20 0.32
OXTR P30559 1/20 0.32
AVPR1A P37288 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
ACACB O00763 3/20 0.31

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
SCHEMBL13732358 0.86 XIAP (0.48) NOTUMKDM1AXIAPBIRC2NR1H2
SCHEMBL26863452 0.83 NOTUM (0.36) NOTUMKDM1ANR1H2SCD5
SCHEMBL30808966 0.82 UCHL1 (0.39) NOTUMKDM1ANR1H2HDAC1HDAC6
SCHEMBL17436484 0.82 NOTUM (0.58) NOTUMXIAPBIRC2CYP11B2
SCHEMBL17807352 0.78 KDM1A (0.43) NOTUMKDM1ANR1H2CYP11B2
SCHEMBL31492094 0.76 XIAP (0.49) NOTUMKDM1AXIAPBIRC2NR1H2
SCHEMBL16441383 0.76 XIAP (0.49) NOTUMKDM1AXIAPBIRC2NR1H2
SCHEMBL13732290 0.75 XIAP (0.45) KDM1AXIAPBIRC2HDAC1HDAC6
SCHEMBL17252097 0.75 NR1H2 (0.49) NOTUMKDM1AXIAPBIRC2NR1H2
SCHEMBL17807330 0.74 NOTUM (0.64) NOTUMKDM1AHDAC1HDAC6HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4543544-A1 TYROSINE KINASE 2 INHIBITORS AND USES THEREOF Biogen MA Inc. (US) 2025-04-30 EP disclosed
CN-119866338-A Tyrosine kinase 2 inhibitors and uses thereof 渤健马萨诸塞州股份有限公司 2025-04-22 CN disclosed
WO-2023250064-A1 TYROSINE KINASE 2 INHIBITORS AND USES THEREOF BIOGEN MA INC. (US) 2023-12-28 WO disclosed