SCHEMBL27449185

SCHEMBL27449185

CCC(O)CCN(C(=O)c1ccc2nc(C)n(Cc3ccc(Cl)cc3Cl)c2c1)[SH](=O)=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 8/20 0.53
▸ LMNA P02545 3/20 0.37
▸ HDAC3 O15379 2/20 0.37
▸ HDAC4 P56524 2/20 0.37
▸ HDAC1 Q13547 2/20 0.37
▸ HDAC7 Q8WUI4 2/20 0.37
▸ HDAC2 Q92769 2/20 0.37
▸ HDAC10 Q969S8 2/20 0.37
▸ HDAC11 Q96DB2 2/20 0.37
▸ HDAC8 Q9BY41 2/20 0.37
▸ HDAC6 Q9UBN7 2/20 0.37
▸ HDAC9 Q9UKV0 2/20 0.37
▸ HDAC5 Q9UQL6 2/20 0.37
▸ VDR P11473 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ THRB P10828 1/20 0.35

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
SCHEMBL27450620 0.88 PPARG (0.55) PPARGLMNAHDAC3HDAC4HDAC1
SCHEMBL27465432 0.88 PPARG (0.53) PPARGLMNAHDAC3HDAC4HDAC1
SCHEMBL27450180 0.88 PPARG (0.53) PPARGLMNAHDAC3HDAC4HDAC1
SCHEMBL27524156 0.81 PPARG (0.47) PPARGSMN1; SMN2ALDH1A1MC4RALOX5AP
SCHEMBL7649138 0.79 PPARG (0.77) PPARGLMNAHDAC3HDAC4HDAC1
SCHEMBL27450178 0.79 PPARG (0.53) PPARGHDAC3HDAC4HDAC1HDAC7
SCHEMBL27467908 0.78 PPARG (0.54) PPARGLMNAHDAC3HDAC4HDAC1
SCHEMBL6170044 0.77 PPARG (0.64) PPARGLMNAHDAC3HDAC4HDAC1
SCHEMBL27465431 0.77 PPARG (0.52) PPARGHDAC3HDAC4HDAC1HDAC7
SCHEMBL6169108 0.77 PPARG (0.63) PPARGLMNAHDAC3HDAC4HDAC1

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-1135224-C Benzimidazole derivatives ����ҩƷ��ҵ��ʽ���� 2004-01-21 — — CN disclosed
CN-1268123-A Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO (JP) 2000-09-27 — — CN disclosed
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