SCHEMBL9570482

SCHEMBL9570482

CC1(C(=O)O)CCC2OC2C1.O=CC1CCC2OC2C1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.33
TP53 P04637 1/20 0.33
NFKB1 P19838 1/20 0.33
CYP2C19 P33261 1/20 0.33
THPO P40225 1/20 0.33
STAT6 P42226 1/20 0.33
HIF1A Q16665 1/20 0.33
NPC1 O15118 1/20 0.33
GMNN O75496 1/20 0.33
LMNA P02545 1/20 0.33
MTOR P42345 1/20 0.33
RAB9A P51151 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
FFAR3 O14843 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
SCHEMBL1547983 0.83 MAPK1 (0.45) MAPK1TP53NFKB1CYP2C19THPO
Oxirane SCHEMBL27707045 0.79 MAPK1 (0.41) MAPK1TP53NFKB1CYP2C19THPO
SCHEMBL263274 0.79 LMNA (0.41) MAPK1TP53NFKB1CYP2C19THPO
Ethylene Glycol SCHEMBL11647682 0.77 MAPK1 (0.40) MAPK1TP53NFKB1CYP2C19THPO
SCHEMBL2729859 0.74
SCHEMBL15681315 0.74
SCHEMBL10063438 0.74
SCHEMBL139696 0.69 FFAR3 (0.54) MAPK1TP53NFKB1CYP2C19THPO
SCHEMBL139695 0.69 FFAR3 (0.54) MAPK1TP53NFKB1CYP2C19THPO
SCHEMBL17928513 0.69 MAPK1 (0.35) MAPK1TP53NFKB1CYP2C19THPO

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
EP-0533094-A1 Method, coating and apparatus for the production of coated hollow glassware Herberts Gesellschaft mit beschränkter Haftung (DE) 1993-03-24 EP disclosed
US-4829124-A BLEND OF CARBOXYLATED ACRYLONITRILE-BURTADIENE COPOLYMER, NEUTRALIZED ETHYLENE-ACRYLIC ACID COPOLYMER AND EPXOY CROSSLINKING AGENT ARMSTRONG WORLD INDUSTRIES, INC. (US) 1989-05-09 US disclosed