SCHEMBL9245224

SCHEMBL9245224

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.44
PIM1 P11309 1/20 0.42
CSNK2A2 P19784 1/20 0.42
CSNK2B P67870 1/20 0.42
CSNK2A1 P68400 1/20 0.42
CSNK2A3 Q8NEV1 1/20 0.42
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
PNP P00491 1/20 0.41
TP53 P04637 1/20 0.41
HTT P42858 1/20 0.41
PDE4D Q08499 1/20 0.41
PDE3A Q14432 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
ADRB1 P08588 1/20 0.40
DNMT1 P26358 1/20 0.40
SLC15A1 P46059 1/20 0.37
HIF1A Q16665 2/20 0.37
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 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
SCHEMBL8184212 0.86 LMNA (0.46) HDAC6PIM1CSNK2A2CSNK2BCSNK2A1
SCHEMBL8184210 0.86 LMNA (0.46) HDAC6PIM1CSNK2A2CSNK2BCSNK2A1
SCHEMBL6955539 0.81 HDAC6 (0.41) HDAC6LMNASMN1; SMN2SLC15A1HIF1A
SCHEMBL6953173 0.81 HDAC6 (0.41) HDAC6LMNASMN1; SMN2SLC15A1HIF1A
SCHEMBL7215122 0.80 HDAC6 (0.68) HDAC6LMNASMN1; SMN2PNPTP53
SCHEMBL7209018 0.80 HDAC6 (0.68) HDAC6LMNASMN1; SMN2PNPTP53
SCHEMBL7209010 0.80 HDAC6 (0.68) HDAC6LMNASMN1; SMN2PNPTP53
SCHEMBL17864249 0.80 HDAC6 (0.68) HDAC6LMNASMN1; SMN2PNPTP53
SCHEMBL6949022 0.79 CCNT1 (0.38) HDAC6SLC15A1
SCHEMBL6949025 0.79 CCNT1 (0.38) HDAC6SLC15A1

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-0556334-A4 POLYSUBSTITUTED BENZIMIDAZOLES AS ANTIVIRAL AGENTS UNIV MICHIGAN (US) 1995-03-29 EP disclosed
EP-0556334-A1 POLYSUBSTITUTED BENZIMIDAZOLES AS ANTIVIRAL AGENTS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1993-08-25 EP disclosed
WO-1992007867-A1 POLYSUBSTITUTED BENZIMIDAZOLES AS ANTIVIRAL AGENTS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1992-05-14 WO disclosed