SCHEMBL2309112

SCHEMBL2309112

CCCCCCC(C)CCCCCCCCCCCCC(O)C(O)COC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CSNK1E P49674 1/20 0.44
▸ TK1 P04183 2/20 0.42
▸ ACE2 Q9BYF1 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ SPHK1 Q9NYA1 2/20 0.37
▸ PLA2G2A P14555 2/20 0.36
▸ PLA2G10 O15496 1/20 0.36
▸ PLA2G1B P04054 1/20 0.36
▸ PLA2G5 P39877 1/20 0.36
▸ PRSS1 P07477 2/20 0.36
▸ PRSS2 P07478 1/20 0.36
▸ PRSS3 P35030 1/20 0.36
▸ DUT P33316 1/20 0.35
▸ CTSG P08311 1/20 0.34
▸ CTRB1 P17538 1/20 0.34
▸ CMA1 P23946 1/20 0.34
▸ SPHK2 Q9NRA0 1/20 0.34
▸ KIF11 P52732 1/20 0.33

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
SCHEMBL1964547 1.00 CSNK1E (0.44) CSNK1ETK1ACE2ALDH1A1SPHK1
SCHEMBL1966482 0.95 CSNK1E (0.48) CSNK1ETK1ALDH1A1SPHK1PLA2G2A
SCHEMBL1966075 0.95 CSNK1E (0.48) CSNK1ETK1ALDH1A1SPHK1PLA2G2A
SCHEMBL2311831 0.95 CSNK1E (0.48) CSNK1ETK1ALDH1A1SPHK1PLA2G2A
SCHEMBL11290300 0.95 CSNK1E (0.48) CSNK1ETK1ALDH1A1SPHK1PLA2G2A
SCHEMBL1964110 0.95 CSNK1E (0.48) CSNK1ETK1ALDH1A1SPHK1PLA2G2A
SCHEMBL1965903 0.95 CSNK1E (0.48) CSNK1ETK1ALDH1A1SPHK1PLA2G2A
SCHEMBL1962165 0.95 CSNK1E (0.48) CSNK1ETK1ALDH1A1SPHK1PLA2G2A
SCHEMBL11148740 0.95 CSNK1E (0.48) CSNK1ETK1ALDH1A1SPHK1PLA2G2A
SCHEMBL1963646 0.95 CSNK1E (0.48) CSNK1ETK1ALDH1A1SPHK1PLA2G2A

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-2348866-A1 OXIDIZED LIPID COMPOUNDS AND USES THEREOF Vascular Biogenics Ltd. (IL) 2011-08-03 — — EP disclosed
WO-2010052718-A1 OXIDIZED LIPID COMPOUNDS AND USES THEREOF VASCULAR BIOGENICS LTD. (IL) 2010-05-14 — — WO disclosed
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