SCHEMBL9153757

SCHEMBL9153757

CCCCCCCCCCCOC1O[C@H](CO)[C@@H]2OC(C)(C)O[C@H]12

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.47
GJB2 P29033 1/20 0.36
GBA1 P04062 1/20 0.36
LGALS8 O00214 1/20 0.35
LGALS3 P17931 1/20 0.35
LGALS4 P56470 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
THPO P40225 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
FGF1 P05230 3/20 0.33
FGF2 P09038 3/20 0.33
VEGFA P15692 3/20 0.33
HPSE Q9Y251 3/20 0.33
TNF P01375 1/20 0.33
CETP P11597 1/20 0.33

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
SCHEMBL9157000 1.00 MAPK1 (0.47) MAPK1GJB2GBA1LGALS8LGALS3
SCHEMBL28294670 0.91 MAPK1 (0.50) MAPK1GJB2GBA1LGALS8LGALS3
SCHEMBL28296334 0.91 MAPK1 (0.50) MAPK1GJB2GBA1LGALS8LGALS3
SCHEMBL6919660 0.86 GJB2 (0.36) MAPK1GJB2GBA1LMNAMEN1
SCHEMBL6918658 0.86 GJB2 (0.36) MAPK1GJB2GBA1LMNAMEN1
SCHEMBL6918062 0.86 GJB2 (0.36) MAPK1GJB2GBA1LMNAMEN1
SCHEMBL8578439 0.82 LGALS8 (0.56) MAPK1GJB2GBA1LGALS8LGALS3
SCHEMBL812311 0.82 PI4KA (0.34) MAPK1LMNA
SCHEMBL29291459 0.80 MAPK1 (0.57) MAPK1GJB2GBA1LGALS8LGALS3
SCHEMBL6270119 0.80 LMNA (0.48) MAPK1GBA1LMNACYP1A2THPO

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
US-5432163-A Anti-proliferative and anti-inflammatory compounds: derivatives of pentose monosaccharides GREENWICH PHARMACEUTICALS INCORPORATED (US) 1995-07-11 US disclosed