SCHEMBL7065211

SCHEMBL7065211

CCC(CCOc1ccc(NC(=O)OC(C)(C)C)c(NCc2ccc(Cl)cc2Cl)c1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.39
HRH3 Q9Y5N1 1/20 0.37
ALDH1A1 P00352 4/20 0.37
HPGD P15428 3/20 0.37
TP53 P04637 2/20 0.37
HTT P42858 2/20 0.37
MAPT P10636 2/20 0.37
GLA P06280 1/20 0.37
XBP1 P17861 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
GAA P10253 2/20 0.35
ROCK2 O75116 1/20 0.34
CHEK2 O96017 1/20 0.34

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
SCHEMBL7064560 0.89 HRH3 (0.39) HRH3HSD17B10HDAC1HDAC8HDAC6
SCHEMBL7068046 0.83 HDAC1 (0.39) HRH3HTTNPSR1HDAC1HDAC8
SCHEMBL6501452 0.82 IDO1 (0.41) IDO1HRH3ALDH1A1HPGDTP53
SCHEMBL7065219 0.82 IDO1 (0.38) IDO1ALDH1A1HPGDTP53HTT
SCHEMBL7070085 0.81 MAPT (0.36) ALDH1A1TP53HTTMAPTNPSR1
SCHEMBL7160232 0.78 HDAC1 (0.42) HRH3HPGDNPSR1HDAC1HDAC8
SCHEMBL7068930 0.78 AAK1 (0.42) HDAC1MEN1KMT2AGAAPPARG
SCHEMBL7066309 0.75 RAB9A (0.47) MAPTSMN1; SMN2MEN1KMT2AGAA
SCHEMBL7129648 0.73 LMNA (0.37) HRH3HTTHSD17B10HDAC1HDAC8
SCHEMBL6487724 0.71 HDAC1 (0.39) HRH3ALDH1A1HPGDMAPTHDAC1

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-2004108686-A2 BENZIMIDAZOLE COMPOUNDS HAVING HYPOGLYCEMIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 WO disclosed