SCHEMBL4299809

SCHEMBL4299809

CC1(C)OB(c2ccc3cc4cc5cc6cc(B7OC(C)(C)C(C)(C)O7)ccc6cc5cc4cc3c2)OC1(C)C

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LPL P06858 13/20 0.59
LIPG Q9Y5X9 13/20 0.59
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
IRAK4 Q9NWZ3 1/20 0.43
CA12 O43570 1/20 0.42
CA3 P07451 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
F11 P03951 1/20 0.41
SNCA P37840 1/20 0.40
ESR2 Q92731 1/20 0.38
HIF1A Q16665 1/20 0.37

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
SCHEMBL2708689 1.00 LPL (0.59) LPLLIPGCA1CA2CA9
SCHEMBL29644319 0.96 LPL (0.62) LPLLIPGCA1CA2CA9
SCHEMBL1293460 0.96 LPL (0.62) LPLLIPGCA1CA2CA9
SCHEMBL13142480 0.94 LPL (0.68) LPLLIPGCA1CA2CA9
SCHEMBL1294059 0.94 LPL (0.61) LPLLIPGCA1CA2CA9
SCHEMBL29387132 0.94 LPL (0.61) LPLLIPGCA1CA2CA9
SCHEMBL11959548 0.91 LPL (0.51) LPLLIPGCA1CA2CA9
SCHEMBL29392121 0.88 LPL (0.75) LPLLIPGCA1CA2CA9
SCHEMBL120527 0.88 LPL (0.75) LPLLIPGCA1CA2CA9
SCHEMBL12654466 0.86 LPL (0.54) LPLLIPGCA1CA2CA9

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7608679-B2 for use in semiconductors, electronics such as organic thin film transistors, light emitting diodes, and photovoltaic cells 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-10-27 US disclosed
EP-2001926-A2 ACENE-THIOPHENE COPOLYMERS 3M Innovative Properties Company (US) 2008-12-17 EP disclosed
WO-2007115021-A2 ACENE-THIOPHENE COPOLYMERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-10-11 WO disclosed
US-20070232781-A1 ACENE-THIOPHENE COPOLYMERS 3M INNOVATIVE PROPERTIES COMPANY 2007-10-04 US disclosed