SCHEMBL12966203

SCHEMBL12966203

Bc1ccc(-c2ccc(CCC)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 1/20 0.45
▸ LIPG Q9Y5X9 1/20 0.45
▸ MCL1 Q07820 1/20 0.44
▸ HRH3 Q9Y5N1 2/20 0.43
▸ NISCH Q9Y2I1 1/20 0.43
▸ CA2 P00918 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ GFER P55789 1/20 0.42
▸ RARB P10826 2/20 0.41
▸ BDKRB2 P30411 3/20 0.41
▸ TSHR P16473 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ SIGMAR1 Q99720 1/20 0.40
▸ MGLL Q99685 1/20 0.39
▸ PLK1 P53350 1/20 0.39

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
SCHEMBL11949749 0.93 LPL (0.50) LPLLIPGNISCHCA2SIGMAR1
SCHEMBL4802707 0.87 LPL (0.54) LPLLIPGMCL1HRH3NISCH
SCHEMBL12966255 0.85 RARB (0.58) LPLLIPGHRH3MAPTRAB9A
SCHEMBL14071659 0.80 TP53 (0.43) LPLLIPGHRH3NISCHCA2
SCHEMBL11566894 0.80 TAAR1 (0.54) LPLLIPGMCL1HRH3NISCH
SCHEMBL142480 0.79 LPL (0.62) LPLLIPGCA2HSD17B10MGLL
SCHEMBL2494547 0.78 CYP1A2 (0.52) LPLLIPGMCL1HRH3NISCH
SCHEMBL1951510 0.78 FFAR1 (0.54) LPLLIPGMCL1NPC1MAPT
SCHEMBL15868702 0.78 CA2 (0.54) LPLLIPGCA2RARBHSD17B10
SCHEMBL9664205 0.78 TAAR1 (0.52) LPLLIPGMCL1HRH3NISCH

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-1836276-B1 LIQUID CRYSTAL COMPOSITION COMPRISING NOVEL SILICON CONTAINING COMPOUNDS AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME LG CHEMICAL LTD (KR) 2012-10-10 — — EP disclosed
EP-1836275-B1 LIQUID CRYSTAL COMPOSITION COMPRISING NOVEL SILICON CONTAINING COMPOUNDS AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME LG CHEMICAL LTD (KR) 2012-10-03 — — EP disclosed
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