SCHEMBL6164958

SCHEMBL6164958

CCCOC(OCC)C(C)[O]

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.33
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL6166563 0.87 LMNA (0.47) LMNATHRB
SCHEMBL6162777 0.86 LMNA (0.35) LMNATHRB
SCHEMBL26641882 0.76 HSD17B10 (0.39) LMNATHRBHSD17B10
SCHEMBL6161595 0.75
SCHEMBL5270484 0.73 HSD17B10 (0.35) LMNATHRBHSD17B10
SCHEMBL4390917 0.72
SCHEMBL9384309 0.71
SCHEMBL14814277 0.71
SCHEMBL13942182 0.71 HSD17B10 (0.36) LMNAHSD17B10
SCHEMBL14814292 0.71

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-1055712-B1 Aqueous ink for ink jet recording MITSUI CHEMICALS INC (JP) 2005-02-16 EP disclosed
EP-1055712-A2 Aqueous ink for ink jet recording Mitsui Chemicals, Inc. (JP) 2000-11-29 EP disclosed