SCHEMBL7213111

SCHEMBL7213111

C[C@@H]1O[C@H](n2c(Br)nc3cc(Cl)c(Cl)cc32)[C@@H](O)[C@H]1O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.50
SLC15A1 P46059 1/20 0.47
ADK P55263 9/20 0.39
CCNT1 O60563 2/20 0.38
CDK9 P50750 2/20 0.38
ADORA3 P0DMS8 1/20 0.37
HSPA8 P11142 1/20 0.36
PNP P00491 2/20 0.33
PTPN1 P18031 1/20 0.31

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
SCHEMBL7115836 1.00 HDAC6 (0.50) HDAC6SLC15A1ADKCCNT1CDK9
SCHEMBL7742274 0.89 HDAC6 (0.43) HDAC6SLC15A1ADKCCNT1CDK9
SCHEMBL7742269 0.89 HDAC6 (0.43) HDAC6SLC15A1ADKCCNT1CDK9
SCHEMBL7124713 0.86 HDAC6 (0.49) HDAC6SLC15A1ADKCCNT1CDK9
SCHEMBL7739177 0.86 HDAC6 (0.49) HDAC6SLC15A1ADKCCNT1CDK9
SCHEMBL7739180 0.86 HDAC6 (0.49) HDAC6SLC15A1ADKCCNT1CDK9
SCHEMBL7739934 0.86 HDAC6 (0.49) HDAC6SLC15A1ADKCCNT1CDK9
SCHEMBL7739913 0.85 SLC15A1 (0.38) HDAC6SLC15A1ADKADORA3HSPA8
SCHEMBL7734303 0.85 SLC15A1 (0.38) HDAC6SLC15A1ADKADORA3HSPA8
SCHEMBL3925775 0.82 HDAC6 (0.69) HDAC6SLC15A1ADKHSPA8

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
US-6617315-B1 Sugar-substituted benzimidazole derivatives are used for the treatment or prophylaxis of restenosis, particularly following angioplasty CHAMBERLAIN STANLEY DAWES (US) 2003-09-09 US disclosed
US-6204249-B1 L-benzimidazole nucleosides GLAXO WELLCOME INC. 2001-03-20 US disclosed