SCHEMBL8979338

SCHEMBL8979338

C=CCOCC(COC(c1ccccc1)(c1ccccc1)c1ccccc1)OCC=C

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KIF11 P52732 1/20 0.37
PLA2G2A P14555 2/20 0.34
PLA2G10 O15496 1/20 0.34
PLA2G1B P04054 1/20 0.34
PLA2G5 P39877 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.33
CYP2D6 P10635 1/20 0.32
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA9 Q16790 1/20 0.31
DUT P33316 2/20 0.31
TK1 P04183 2/20 0.30
CA7 P43166 1/20 0.30
PPARD Q03181 1/20 0.30

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
SCHEMBL10802176 0.89 CA1 (0.39) MEN1KMT2AKIF11PLA2G2APLA2G10
SCHEMBL10805897 0.89 ALOX15 (0.34) MEN1KMT2AKIF11PLA2G2APLA2G10
SCHEMBL8174806 0.87 KIF11 (0.38) MEN1KMT2AKIF11PLA2G2APLA2G10
SCHEMBL8175157 0.87 KIF11 (0.38) MEN1KMT2AKIF11PLA2G2APLA2G10
SCHEMBL8979363 0.86 PLA2G2A (0.49) MEN1KMT2AKIF11PLA2G2APLA2G10
SCHEMBL2619910 0.82 MEN1 (0.43) MEN1KMT2AKIF11ALDH1A1TSHR
SCHEMBL8004769 0.82 AOC3 (0.37) KIF11PLA2G2APLA2G10PLA2G1BPLA2G5
SCHEMBL27859924 0.81 CA1 (0.45) KIF11ALDH1A1TSHRHTTCYP2D6
SCHEMBL8004766 0.77 PGR (0.32)
SCHEMBL10565436 0.77 TSHR (0.37) MEN1KMT2AKIF11ALDH1A1TSHR

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-0710225-A1 FLUORESCENCE DETERMINATION OF THE ACTIVITY OF LIPOLYTIC ENZYMES PROGEN Biotechnik GmbH (DE) 1996-05-08 EP disclosed
WO-1995032181-A1 FLUORESCENCE DETERMINATION OF THE ACTIVITY OF LIPOLYTIC ENZYMES PROGEN BIOTECHNIK GMBH (DE) 1995-11-30 WO disclosed