SCHEMBL27949745

SCHEMBL27949745

CCCCCCc1csc(B2OCC(C)(C)C(C)(C)O2)c1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 6/20 0.45
▸ LIPG Q9Y5X9 6/20 0.45
▸ PTGS2 P35354 2/20 0.31
▸ OPRM1 P35372 3/20 0.31

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
SCHEMBL15072065 0.86 LPL (0.56) LPLLIPGPTGS2OPRM1
SCHEMBL121471 0.86 LPL (0.56) LPLLIPGPTGS2OPRM1
SCHEMBL31516134 0.86 LPL (0.56) LPLLIPGPTGS2OPRM1
SCHEMBL868509 0.85 LPL (0.40) LPLLIPGPTGS2OPRM1
SCHEMBL14941616 0.85 LPL (0.40) LPLLIPGPTGS2OPRM1
SCHEMBL9891143 0.84 LPL (0.55) LPLLIPGPTGS2OPRM1
SCHEMBL12913268 0.80 LPL (0.49) LPLLIPGOPRM1
SCHEMBL27949914 0.80 LPL (0.52) LPLLIPGPTGS2OPRM1
SCHEMBL28128548 0.77 LPL (0.72) LPLLIPGPTGS2
SCHEMBL28128198 0.77 LPL (0.72) LPLLIPGPTGS2

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
CN-103554100-A Preparation method and application of organic solar cell material UNIV NANJING POSTS & TELECOMM 2014-02-05 — — CN disclosed
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