SCHEMBL28568885

SCHEMBL28568885

CC(C)(CC1C(=O)N(Cc2ccccc2)CC1CF)NC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SIRT5 Q9NXA8 1/20 0.45
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ PREP P48147 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ CCKBR P32239 1/20 0.36
▸ BRD4 O60885 1/20 0.36

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
SCHEMBL20722883 0.75 CCKBR (0.47) SIRT5MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL20722523 0.73 KMT2A (0.50) SIRT5MEN1KMT2AALDH1A1TSHR
SCHEMBL20722526 0.73 KMT2A (0.50) SIRT5MEN1KMT2AALDH1A1TSHR
SCHEMBL20722524 0.73 KMT2A (0.50) SIRT5MEN1KMT2AALDH1A1TSHR
SCHEMBL20722497 0.72 KMT2A (0.49) SIRT5MEN1KMT2AALDH1A1TSHR
SCHEMBL21685914 0.72 KMT2A (0.49) SIRT5MEN1KMT2AALDH1A1TSHR
SCHEMBL21685866 0.66 SIRT5 (0.38) SIRT5MEN1KMT2ATSHR
SCHEMBL20722557 0.66 SIRT5 (0.38) SIRT5MEN1KMT2ATSHR
SCHEMBL21685864 0.66 SIRT5 (0.38) SIRT5MEN1KMT2ATSHR
SCHEMBL28645283 0.65 GAA (0.39) MEN1KMT2AALDH1A1

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-112867712-A Carboxamides as ubiquitin-specific protease inhibitors 瓦洛早期发现股份有限公司 2021-05-28 — — CN disclosed
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