SCHEMBL13397756

SCHEMBL13397756

COc1ccc(Oc2ccc(OP(C)(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.57
HTT P42858 3/20 0.53
PKM P14618 1/20 0.53
HPGD P15428 1/20 0.50
TDP1 Q9NUW8 2/20 0.46
PGR P06401 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
ACP3 P15309 1/20 0.44
CA4 P22748 2/20 0.43
LMNA P02545 2/20 0.43
PNLIP P16233 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
POLB P06746 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CA12 O43570 1/20 0.41

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 0.95 HTT (0.57) LTA4HHTTPKMHPGDTDP1
SCHEMBL13397637 0.85 LTA4H (0.61) LTA4HHTTPKMHPGDTDP1
SCHEMBL13397754 0.85 HTT (0.49) LTA4HHTTPKMHPGDTDP1
SCHEMBL13171163 0.84 HTT (0.48) HTTPKMHPGDTDP1MEN1
SCHEMBL17943685 0.84 PKM (0.58) HTTPKMHPGDPGRCA4
SCHEMBL407307 0.83 L3MBTL1 (0.61) HTTPKMHPGDTDP1MEN1
SCHEMBL13397924 0.81 HPGD (0.45) LTA4HHTTPKMHPGDTDP1
SCHEMBL28193244 0.80 CYP3A4 (0.55) HPGDTDP1MEN1KMT2AALDH1A1
SCHEMBL14148854 0.80 LTA4H (0.63) LTA4HHTTPKMHPGDPGR
SCHEMBL13397802 0.79 HTT (0.43) HTTPKMHPGDTDP1PGR

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