SCHEMBL7209018

SCHEMBL7209018

CC(C)Nc1nc2cc(Cl)c(Cl)cc2n1[C@H]1C[C@H](O)[C@@H](CO)O1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.68
CCNT1 O60563 2/20 0.39
CDK9 P50750 2/20 0.39
PNP P00491 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
HTT P42858 1/20 0.37
PDE4D Q08499 1/20 0.37
PDE3A Q14432 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
ADRB1 P08588 1/20 0.36
DNMT1 P26358 1/20 0.36

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
SCHEMBL7215122 1.00 HDAC6 (0.68) HDAC6CCNT1CDK9PNPLMNA
SCHEMBL17864249 1.00 HDAC6 (0.68) HDAC6CCNT1CDK9PNPLMNA
SCHEMBL7209010 1.00 HDAC6 (0.68) HDAC6CCNT1CDK9PNPLMNA
SCHEMBL7215077 0.82 HDAC6 (0.69) HDAC6CCNT1CDK9
SCHEMBL7215079 0.82 HDAC6 (0.69) HDAC6CCNT1CDK9
SCHEMBL17864244 0.82 HDAC6 (0.69) HDAC6CCNT1CDK9
Maribavir SCHEMBL7634766 0.81 HDAC6 (1.00) HDAC6LMNASMN1; SMN2RXFP1
Maribavir SCHEMBL18459197 0.81 HDAC6 (1.00) HDAC6LMNASMN1; SMN2RXFP1
Maribavir SCHEMBL1028527 0.81 HDAC6 (1.00) HDAC6LMNASMN1; SMN2RXFP1
Maribavir SCHEMBL13082009 0.81 HDAC6 (1.00) HDAC6LMNASMN1; SMN2RXFP1

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 8 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 claimed
US-6204249-B1 L-benzimidazole nucleosides GLAXO WELLCOME INC. 2001-03-20 US claimed
EP-0876389-A1 THERAPEUTIC COMPOUNDS GLAXO GROUP LIMITED (GB) 1998-11-11 EP claimed
WO-1997025337-A1 THERAPEUTIC COMPOUNDS GLAXO GROUP LIMITED (GB) 1997-07-17 WO claimed
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
EP-0876389-A1 THERAPEUTIC COMPOUNDS GLAXO GROUP LIMITED (GB) 1998-11-11 EP disclosed
WO-1997025337-A1 THERAPEUTIC COMPOUNDS GLAXO GROUP LIMITED (GB) 1997-07-17 WO disclosed