SCHEMBL3281285

SCHEMBL3281285

O=CO[PH](=O)Oc1cccc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
HSD17B10 Q99714 3/20 0.41
KDM4E B2RXH2 3/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HPGD P15428 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PGR P06401 1/20 0.39
GAA P10253 1/20 0.39
PTGS1 P23219 1/20 0.39
MAPK1 P28482 1/20 0.39
HTR1B P28222 8/20 0.39
KCNA3 P22001 1/20 0.37
HTR1D P28221 2/20 0.36
OGG1 O15527 1/20 0.36
SLC6A4 P31645 1/20 0.35
HRH1 P35367 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL3281541 0.85 ALDH1A1 (0.36) ALDH1A1HSD17B10KDM4EKMT2AMEN1
SCHEMBL81301 0.85 ALDH1A1 (0.49) ALDH1A1HSD17B10KDM4EKMT2AMEN1
SCHEMBL27730905 0.85 ALDH1A1 (0.41) ALDH1A1HSD17B10KDM4EKMT2AMEN1
SCHEMBL3172368 0.79 ALDH1A1 (0.47) ALDH1A1HSD17B10KDM4EKMT2AMEN1
SCHEMBL27918672 0.77 KCNA3 (0.49) ALDH1A1HSD17B10KDM4EKMT2AMEN1
SCHEMBL28657853 0.76 ALDH1A1 (0.41) ALDH1A1HSD17B10KDM4EKMT2AMEN1
SCHEMBL3811620 0.75 HPRT1 (0.52) ALDH1A1HSD17B10KDM4EKMT2AMEN1
SCHEMBL28197479 0.75 HTR1B (0.49) ALDH1A1HSD17B10KDM4EKMT2AMEN1
SCHEMBL27712647 0.75 ALDH1A1 (0.44) ALDH1A1HSD17B10KDM4EHPGDTDP1
SCHEMBL28075001 0.75 TSHR (0.47) ALDH1A1HSD17B10KDM4EHPGDTDP1

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
US-7704939-B2 Surfactant SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2010-04-27 US disclosed
US-20070167343-A1 neutralized salt including alkylbenzenesulphonates (toluenesulfonic acid guanidine salt, toluenesulfonic acid DBU salt, toluenesulfonic acid DBN salt) for cleaning electonics SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2007-07-19 US disclosed