SCHEMBL8959196

SCHEMBL8959196

CC(C)(C)OC(=O)N[C@@H](CCC(N)=O)C(=O)On1nnc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 4/20 0.40
▸ HDAC1 Q13547 4/20 0.40
▸ HDAC3 O15379 3/20 0.40
▸ HDAC7 Q8WUI4 3/20 0.40
▸ HDAC2 Q92769 3/20 0.40
▸ HDAC10 Q969S8 3/20 0.40
▸ HDAC11 Q96DB2 3/20 0.40
▸ HDAC8 Q9BY41 3/20 0.40
▸ HDAC6 Q9UBN7 3/20 0.40
▸ HDAC9 Q9UKV0 3/20 0.40
▸ HDAC5 Q9UQL6 3/20 0.40
▸ PPARG P37231 3/20 0.39
▸ PPARA Q07869 3/20 0.39
▸ PPARD Q03181 2/20 0.39
▸ SIRT2 Q8IXJ6 3/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ REN P00797 1/20 0.38
▸ CTSS P25774 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
SCHEMBL5603250 0.85 HDAC3 (0.42) HDAC4HDAC1HDAC3HDAC7HDAC2
SCHEMBL10625651 0.82 SYK (0.43) PPARGPPARANPC1RAB9ASMN1; SMN2
SCHEMBL1609729 0.80 HDAC3 (0.46) HDAC4HDAC1HDAC3HDAC7HDAC2
SCHEMBL10626852 0.79 SYK (0.44) NPC1RAB9ASMN1; SMN2CTSSCTSK
SCHEMBL29044862 0.77 PPARG (0.58) HDAC4HDAC1HDAC3HDAC7HDAC2
SCHEMBL27349797 0.76 APAF1 (0.50) NPC1RAB9ASMN1; SMN2REN
SCHEMBL10625625 0.75 NPC1 (0.47) HDAC4HDAC1HDAC3HDAC7HDAC2
SCHEMBL10883348 0.74 PPARA (0.54) PPARGPPARASMN1; SMN2RENCTSS
SCHEMBL9468935 0.74 CYP1A2 (0.37) PPARGPPARARENCTSSCTSK
SCHEMBL2899548 0.74 PPARA (0.54) PPARGPPARASMN1; SMN2RENCTSS

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
EP-0423649-B1 Peptides and use thereof KURARAY CO (JP) 1996-01-24 — — EP disclosed
US-5194586-A Adult T Cell Leukemia Associated Antigen KURARAY CO., LTD. (JP) 1993-03-16 — — US disclosed
EP-0423649-A1 Peptides and use thereof Kuraray Co., Ltd. (JP) 1991-04-24 — — EP disclosed
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