SCHEMBL26425968

SCHEMBL26425968

CCOC(=O)/C(C)=C/c1ccc(-c2nc(Cc3cccc(Cl)c3)no2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ERCC1 P07992 1/20 0.42
ERCC4 Q92889 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.40
LMNA P02545 5/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
NOTUM Q6P988 1/20 0.39
PTGS2 P35354 1/20 0.39
MAPK1 P28482 3/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
DGAT1 O75907 1/20 0.38
HDAC6 Q9UBN7 1/20 0.37
SRC P12931 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
SCHEMBL30408238 1.00 HTT (0.48) HTTNPC1RAB9AALDH1A1HPGD
SCHEMBL30408552 0.88 NPC1 (0.53) HTTNPC1RAB9AALDH1A1HPGD
SCHEMBL26134387 0.88 NPC1 (0.53) HTTNPC1RAB9AALDH1A1HPGD
SCHEMBL26425660 0.84 NPC1 (0.47) HTTNPC1RAB9AALDH1A1HPGD
SCHEMBL30407330 0.84 NPC1 (0.47) HTTNPC1RAB9AALDH1A1HPGD
SCHEMBL26087633 0.77 NPC1 (0.55) HTTNPC1RAB9AALDH1A1HPGD
SCHEMBL31024154 0.77 NPC1 (0.55) HTTNPC1RAB9AALDH1A1HPGD
SCHEMBL26425647 0.77 NPC1 (0.63) HTTNPC1RAB9AALDH1A1HPGD
SCHEMBL26090394 0.76 NPC1 (0.53) HTTNPC1RAB9AALDH1A1HPGD
SCHEMBL26425656 0.75 NPC1 (0.54) HTTNPC1RAB9AALDH1A1HPGD

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
CN-118302414-A Oxazole, oxadiazole and indole derivatives useful for inhibiting USP28 卡莫特医疗有限公司 2024-07-05 CN disclosed
WO-2023069721-A2 OXAZOLE, OXADIAZOLE, AND INDOLE DERIVATIVES FOR THE INHIBITION OF USP28 CARMOT THERAPEUTICS, INC. (US) 2023-04-27 WO disclosed