SCHEMBL31517514

SCHEMBL31517514

CC(C)(C)OC(=O)n1nc(C2COC2)cc1N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ ELANE P08246 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ NR1H2 P55055 1/20 0.34
▸ SMARCA2 P51531 1/20 0.33
▸ SMARCA4 P51532 1/20 0.33
▸ PBRM1 Q86U86 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ HSP90AB1 P08238 1/20 0.33
▸ FAAH O00519 1/20 0.33
▸ GPR119 Q8TDV5 2/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ DPP4 P27487 1/20 0.32

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
SCHEMBL173999 0.88 KDM4E (0.41) SMN1; SMN2KDM4EMAPTTHRBGAA
SCHEMBL6783179 0.85 KDM4E (0.40) SMN1; SMN2KDM4EMAPTTHRBELANE
SCHEMBL6621580 0.85 NPC1 (0.42) SMN1; SMN2KDM4EMAPTTHRBELANE
SCHEMBL10255933 0.84 KDM4E (0.41) USP2SMN1; SMN2KDM4EMAPTTHRB
SCHEMBL31517346 0.82 KDM4E (0.35) KDM4EMAPTTHRBELANEHTT
SCHEMBL31517302 0.79 KCNJ6 (0.35) KDM4EMAPTTHRBELANENR1H2
SCHEMBL174902 0.77 ALDH1A1 (0.43) KDM4EELANENR1H2HSP90AA1HSP90AB1
SCHEMBL25249092 0.73 HSP90AA1 (0.43) SMN1; SMN2KDM4EMAPTTHRBELANE
SCHEMBL667656 0.73 KDM4E (0.40) KDM4EMAPTTHRBELANENR1H2
SCHEMBL23500483 0.73 FAAH (0.38) KDM4EMAPTTHRBELANENR1H2

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
WO-2025040546-A1 PYRAZOLE COMPOUNDS AS CULLIN RING UBIQUITIN LIGASE COMPOUNDS PROXYGEN GMBH (AT) 2025-02-27 — — WO disclosed
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