SCHEMBL6275636

SCHEMBL6275636

CCCCCCCO[C@H]1[C@@H](C(N)O)OC2OC(C)(C)O[C@@H]21

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.58
CYP1A2 P05177 1/20 0.58
THPO P40225 1/20 0.58
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
GBA1 P04062 5/20 0.38
ALDH1A1 P00352 2/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 1/20 0.36
ATM Q13315 1/20 0.36
GSTA2 P09210 2/20 0.32
GSTP1 P09211 2/20 0.32
GSTM1 P09488 1/20 0.32

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
SCHEMBL6278733 1.00 LMNA (0.58) LMNACYP1A2THPOKMT2AMEN1
SCHEMBL6277176 0.88 LMNA (0.61) LMNACYP1A2THPOKMT2AMEN1
SCHEMBL9401393 0.88 LMNA (0.74) LMNACYP1A2THPOKMT2AMEN1
SCHEMBL6818606 0.88 LMNA (0.74) LMNACYP1A2THPOKMT2AMEN1
SCHEMBL9401471 0.88 LMNA (0.74) LMNACYP1A2THPOKMT2AMEN1
SCHEMBL9401301 0.88 LMNA (0.74) LMNACYP1A2THPOKMT2AMEN1
Seprilose SCHEMBL636340 0.88 LMNA (0.74) LMNACYP1A2THPOKMT2AMEN1
SCHEMBL9253047 0.88 LMNA (0.74) LMNACYP1A2THPOKMT2AMEN1
SCHEMBL8058955 0.86 LMNA (0.76) LMNACYP1A2THPOKMT2AMEN1
SCHEMBL12957520 0.83 LMNA (0.61) LMNACYP1A2THPOKMT2AMEN1

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-2005092907-A2 MONOSACCHARIDE DERIVATIVES AS ANTI-CANCER AND ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2005-10-06 WO disclosed