SCHEMBL9301463

SCHEMBL9301463

CCCCCCC1CC(=O)OC(CCCCCC)CC(=O)OC(CCCCCC)CC(=O)O1

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.70
PPARG P37231 2/20 0.59
ALDH1A1 P00352 1/20 0.54
SIRT2 Q8IXJ6 6/20 0.50
EPHX1 P07099 1/20 0.50
GRM2 Q14416 5/20 0.46
ABCB1 P08183 1/20 0.45

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
SCHEMBL15658385 0.98 CYP1A2 (0.67) CYP1A2PPARGALDH1A1SIRT2EPHX1
SCHEMBL6116259 0.98 CYP1A2 (0.67) CYP1A2PPARGALDH1A1SIRT2EPHX1
SCHEMBL8176788 0.98 CYP1A2 (0.67) CYP1A2PPARGALDH1A1SIRT2EPHX1
SCHEMBL7024404 0.98 CYP1A2 (0.67) CYP1A2PPARGALDH1A1SIRT2EPHX1
SCHEMBL11510187 0.98 CYP1A2 (0.67) CYP1A2PPARGALDH1A1SIRT2EPHX1
SCHEMBL15656881 0.98 CYP1A2 (0.67) CYP1A2PPARGALDH1A1SIRT2EPHX1
SCHEMBL7163554 0.98 CYP1A2 (0.67) CYP1A2PPARGALDH1A1SIRT2EPHX1
SCHEMBL20625376 0.98 CYP1A2 (0.67) CYP1A2PPARGALDH1A1SIRT2EPHX1
SCHEMBL20803560 0.98 CYP1A2 (0.67) CYP1A2PPARGALDH1A1SIRT2EPHX1
SCHEMBL8350663 0.98 CYP1A2 (0.67) CYP1A2PPARGALDH1A1SIRT2EPHX1

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-5286842-A Process for producing a biodegradable polymer MITSUBISHI KASEI CORPORATION (JP) 1994-02-15 US disclosed
EP-0522422-A2 Process for producing a biodegradable polymer Mitsubishi Chemical Corporation (JP) 1993-01-13 EP disclosed