SCHEMBL8955549

SCHEMBL8955549

Cc1ccc(OCCCCCCCCO)cc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.54
GAA P10253 1/20 0.54
DRD2 P14416 1/20 0.51
DRD4 P21917 1/20 0.51
DRD3 P35462 1/20 0.51
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
KMT2A Q03164 1/20 0.50
HTT P42858 1/20 0.48
PDIA6 Q15084 1/20 0.47
MAPK1 P28482 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPT P10636 3/20 0.46
KDM4E B2RXH2 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL26118017 1.00 TP53 (0.54) TP53GAADRD2DRD4DRD3
SCHEMBL586116 0.86 DRD2 (0.51) TP53GAADRD2DRD4DRD3
SCHEMBL26548060 0.86 TP53 (0.51) TP53GAAPDIA6MAPK1PDK2
SCHEMBL17637581 0.84 DRD2 (0.61) DRD2DRD4DRD3RAB9ASMN1; SMN2
SCHEMBL9252588 0.83 NR5A1 (0.56) TP53DRD2DRD4DRD3RAB9A
SCHEMBL11375096 0.83 NR5A1 (0.56) TP53DRD2DRD4DRD3RAB9A
SCHEMBL14015787 0.83 NR5A1 (0.56) TP53DRD2DRD4DRD3RAB9A
SCHEMBL11369041 0.83 NR5A1 (0.56) TP53DRD2DRD4DRD3RAB9A
SCHEMBL10282187 0.82 PDIA6 (0.49) TP53GAADRD2DRD4DRD3
SCHEMBL3763682 0.82 DRD2 (0.58) DRD2DRD4DRD3RAB9ASMN1; SMN2

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-5516767-A PRODRUG AS HYPOGLYCEMIC AGENT SANDOZ LTD. (CH) 1996-05-14 US disclosed
US-5412137-A Hypoglycemic agents SANDOZ LTD. (CH) 1995-05-02 US disclosed