SCHEMBL29893726

SCHEMBL29893726

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

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PKN1 Q16512 1/20 0.47
▸ PKN2 Q16513 1/20 0.47
▸ KDM4E B2RXH2 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ PIK3CB P42338 1/20 0.39
▸ LCK P06239 1/20 0.38
▸ PTGER4 P35408 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ PTGDR2 Q9Y5Y4 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
SCHEMBL24744762 1.00 PKN1 (0.47) PKN1PKN2KDM4EALDH1A1PIK3CB
SCHEMBL24744761 0.88 KDM4E (0.46) PKN1PKN2KDM4EALDH1A1PIK3CB
SCHEMBL30952847 0.88 KDM4E (0.46) PKN1PKN2KDM4EALDH1A1PIK3CB
SCHEMBL24745161 0.84 PTGDR2 (0.50) PKN1PKN2KDM4EPIK3CBLCK
SCHEMBL30000721 0.84 PTGDR2 (0.50) PKN1PKN2KDM4EPIK3CBLCK
SCHEMBL24745449 0.84 CACNA1B (0.40) PKN1PKN2KDM4EALDH1A1PTGER4
SCHEMBL24745728 0.83 ALDH1A1 (0.37) PKN1PKN2KDM4EALDH1A1MAPT
SCHEMBL24744896 0.82 KDM4E (0.36) PKN1PKN2KDM4EALDH1A1PTGER4
SCHEMBL24745467 0.82 ALDH1A1 (0.37) PKN1PKN2KDM4EALDH1A1MAPT
SCHEMBL24745532 0.82 DCTPP1 (0.38) KDM4EALDH1A1MAPTSMN1; SMN2

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
CN-115023419-A Cereblon-bound piperidine-2, 6-diones and methods of use thereof 凯普托尔治疗学股份有限公司 2022-09-06 — — CN disclosed
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