SCHEMBL24745161

SCHEMBL24745161

COC(=O)c1cccc2c1nc(C)n2CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 5/20 0.50
KDM4E B2RXH2 3/20 0.48
HPGD P15428 1/20 0.48
PKN1 Q16512 1/20 0.46
PKN2 Q16513 1/20 0.46
PIK3CB P42338 1/20 0.43
PTGER4 P35408 1/20 0.41
MAPT P10636 1/20 0.41
LCK P06239 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
AKR1B10 O60218 1/20 0.40
GSK3B P49841 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
SCHEMBL30000721 1.00 PTGDR2 (0.50) PTGDR2KDM4EHPGDPKN1PKN2
SCHEMBL7485320 0.84 NPSR1 (0.44) KDM4EHPGDPKN1PKN2PTGER4
SCHEMBL29893726 0.84 PKN1 (0.47) PTGDR2KDM4EPKN1PKN2PIK3CB
SCHEMBL24744762 0.84 PKN1 (0.47) PTGDR2KDM4EPKN1PKN2PIK3CB
SCHEMBL24746679 0.80 THRB (0.46) PTGDR2KDM4EHSD17B10ATMAKR1B10
SCHEMBL3164934 0.79 KDM4E (0.46) KDM4EHSD17B10LMNATSHRHTT
SCHEMBL7477385 0.79 PARP1 (0.49) KDM4EPKN1PKN2PIK3CBMAPT
SCHEMBL31498298 0.78 MAPT (0.45) KDM4EPKN1PKN2PIK3CBMAPT
SCHEMBL24745731 0.77 KDM4E (0.42) KDM4EHPGDPKN1PKN2PTGER4
SCHEMBL24744939 0.77 SMN1; SMN2 (0.41) KDM4EPKN1PKN2PIK3CBPTGER4

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
CN-117957218-A Targeted protein degradation using bifunctional compounds that bind to ubiquitin ligases and target MCL-1 proteins 凯普托尔治疗学股份有限公司 2024-04-30 CN disclosed
WO-2022255888-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN CAPTOR THERAPEUTICS S.A. (PL) 2022-12-08 WO disclosed
WO-2022253713-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN CAPTOR THERAPEUTICS S.A. (PL) 2022-12-08 WO disclosed