SCHEMBL14979532

SCHEMBL14979532

CCCCCC(C)(O)c1cccc(CCCN)c1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.46
LPL P06858 2/20 0.42
LIPG Q9Y5X9 2/20 0.42
TAAR1 Q96RJ0 1/20 0.42
SCN5A Q14524 3/20 0.40
SCN9A Q15858 3/20 0.40
PPARG P37231 2/20 0.40
PPARA Q07869 2/20 0.40

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
SCHEMBL612555 0.99 KIF11 (0.45) KIF11LPLLIPGTAAR1SCN5A
SCHEMBL612976 0.96 KIF11 (0.47) KIF11LPLLIPGTAAR1PPARG
SCHEMBL10237600 0.93 KIF11 (0.49) KIF11LPLLIPGTAAR1PPARG
SCHEMBL10236374 0.91 LPL (0.46) LPLLIPGSCN5ASCN9APPARG
SCHEMBL10235741 0.90 LPL (0.48) LPLLIPGSCN5ASCN9APPARG
SCHEMBL10235736 0.87 LPL (0.44) KIF11LPLLIPGPPARGPPARA
SCHEMBL13959780 0.83 KIF11 (0.48) KIF11LPLLIPGTAAR1
SCHEMBL3859063 0.82 LPL (0.40) KIF11LPLLIPGPPARGPPARA
SCHEMBL14642898 0.81 KIF11 (0.49) KIF11LPLLIPGTAAR1
SCHEMBL4948885 0.81 TAAR1 (0.50) KIF11TAAR1

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-8450527-B2 Amine derivative compounds for treating ophthalmic diseases and disorders ACUCELA INC. (US) 2013-05-28 US disclosed