SCHEMBL14939281

SCHEMBL14939281

CCCCCCCCCCCCCCCCOC=C(C)C

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.43
GBA1 P04062 1/20 0.43
THRB P10828 2/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 3/20 0.41
LPAR3 Q9UBY5 6/20 0.40
LPAR2 Q9HBW0 5/20 0.40
LPAR1 Q92633 2/20 0.40
NAAA Q02083 1/20 0.40
CES1 P23141 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
HCAR2 Q8TDS4 1/20 0.38
EPHX1 P07099 1/20 0.38

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
SCHEMBL4429063 1.00 CES2 (0.43) CES2GBA1THRBMEN1HTT
SCHEMBL4429558 1.00 CES2 (0.43) CES2GBA1THRBMEN1HTT
SCHEMBL4425605 1.00 CES2 (0.43) CES2GBA1THRBMEN1HTT
SCHEMBL4432502 1.00 CES2 (0.43) CES2GBA1THRBMEN1HTT
SCHEMBL4437405 1.00 CES2 (0.43) CES2GBA1THRBMEN1HTT
SCHEMBL5077032 1.00 CES2 (0.43) CES2GBA1THRBMEN1HTT
SCHEMBL4427588 1.00 CES2 (0.43) CES2GBA1THRBMEN1HTT
SCHEMBL4430804 0.98 CES2 (0.40) CES2GBA1THRBMEN1HTT
SCHEMBL4429201 0.90
SCHEMBL4371579 0.90 CES2 (0.30) CES2GBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2776545-B1 CANDLE WAX COMPRISING A POLYMER AND METHOD FOR MAKING CANDLE WAX Nchem BVBA (BE) 2017-10-11 EP disclosed
US-9580669-B2 Candle wax comprising a polymer and method for making candle wax Nchem BVBA (BE) 2017-02-28 US disclosed
US-20140290126-A1 CANDLE WAX COMPRISING A POLYMER AND METHOD FOR MAKING CANDLE WAX Nchem BVBA (BE) 2014-10-02 US disclosed
EP-2776545-A1 CANDLE WAX COMPRISING A POLYMER AND METHOD FOR MAKING CANDLE WAX N-Chemie Comm. V. (BE) 2014-09-17 EP disclosed
WO-2013068385-A1 CANDLE WAX COMPRISING A POLYMER AND METHOD FOR MAKING CANDLE WAX N-CHEMIE COMM. V. (BE) 2013-05-16 WO disclosed