SCHEMBL26427463

SCHEMBL26427463

CC(C)(C)OC(=O)N1CC2(CNC(=O)CN2OC(=O)c2ccccc2)C1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.40
KDM4E B2RXH2 1/20 0.38
PKM P14618 1/20 0.38
USP30 Q70CQ3 3/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
CRBN Q96SW2 3/20 0.37
GPR119 Q8TDV5 1/20 0.36
DDB1 Q16531 2/20 0.36
RORC P51449 2/20 0.35
BTK Q06187 1/20 0.35
NR1H2 P55055 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL26427466 0.82 MAPK1 (0.43) MAPK1KDM4EPKMUSP30MEN1
SCHEMBL26136524 0.76 NR1H2 (0.38) MAPK1KDM4EUSP30CRBNGPR119
SCHEMBL26089899 0.75 NR1H2 (0.41) MAPK1KDM4ECRBNGPR119DDB1
SCHEMBL26090531 0.75 NPC1 (0.43) MAPK1MEN1KMT2ACRBNDDB1
SCHEMBL26427482 0.74 KDM4E (0.39) MAPK1KDM4EPKMUSP30MEN1
SCHEMBL26427476 0.74 KDM4E (0.39) MAPK1KDM4EPKMUSP30MEN1
SCHEMBL26427489 0.72 MEN1 (0.42) MAPK1KDM4EPKMUSP30MEN1
SCHEMBL26427522 0.70 KDM4E (0.40) KDM4EPKMUSP30MEN1KMT2A
SCHEMBL30485035 0.70 TSHR (0.40) MAPK1KMT2ACRBNDDB1TSHR
SCHEMBL25770784 0.69 KDM4E (0.44) MAPK1KDM4EPKMUSP30MEN1

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
WO-2023067354-A1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF CANCER ARTIOS PHARMA LIMITED (GB) 2023-04-27 WO disclosed
WO-2023067353-A1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF CANCER ARTIOS PHARMA LIMITED (GB) 2023-04-27 WO disclosed