SCHEMBL13397754

SCHEMBL13397754

COc1ccc(Sc2ccc(OP(C)(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.49
PKM P14618 1/20 0.49
HPGD P15428 1/20 0.46
LMNA P02545 2/20 0.44
MMP2 P08253 2/20 0.43
MMP9 P14780 2/20 0.43
MMP12 P39900 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
ACP3 P15309 1/20 0.41
PTGIR P43119 1/20 0.41
POLB P06746 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
CA4 P22748 2/20 0.39
LTA4H P09960 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL13397921 0.90 HTT (0.57) HTTPKMHPGDLMNATDP1
SCHEMBL13397756 0.85 LTA4H (0.57) HTTPKMHPGDLMNATDP1
SCHEMBL13397637 0.81 LTA4H (0.61) HTTPKMHPGDTDP1L3MBTL1
SCHEMBL17943685 0.80 PKM (0.58) HTTPKMHPGDMMP2MMP9
SCHEMBL13171163 0.80 HTT (0.48) HTTPKMHPGDLMNATDP1
SCHEMBL407307 0.79 L3MBTL1 (0.61) HTTPKMHPGDLMNATDP1
SCHEMBL13397802 0.79 HTT (0.43) HTTPKMHPGDLMNATDP1
SCHEMBL2272158 0.77 CA4 (0.59) HTTHPGDLMNAMMP2MMP9
SCHEMBL13397924 0.77 HPGD (0.45) HTTPKMHPGDTDP1ACP3
SCHEMBL28193244 0.76 CYP3A4 (0.55) HPGDLMNATDP1L3MBTL1NPSR1

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-8642165-B2 Organic-inorganic hybrid composition FUJIFILM CORPORATION (JP) 2014-02-04 US disclosed
US-20100104842-A1 ORGANIC-INORGANIC HYBRID COMPOSITION FUJIFILM CORPORATION (JP) 2010-04-29 US disclosed