SCHEMBL28290968

SCHEMBL28290968

CCCCC[P](=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.39
CES1 P23141 3/20 0.39
EPHX2 P34913 1/20 0.38
PKM P14618 1/20 0.38
NAAA Q02083 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
LTA4H P09960 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 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
SCHEMBL27411393 0.98 CES2 (0.41) CES2CES1EPHX2PKMNAAA
SCHEMBL9769194 0.98 CES2 (0.41) CES2CES1EPHX2PKMNAAA
SCHEMBL27484212 0.98 CES2 (0.41) CES2CES1EPHX2PKMNAAA
SCHEMBL27519999 0.98 CES2 (0.41) CES2CES1EPHX2PKMNAAA
SCHEMBL27520003 0.98 CES2 (0.41) CES2CES1EPHX2PKMNAAA
SCHEMBL29184853 0.96 CES2 (0.40) CES2CES1EPHX2PKMNAAA
SCHEMBL17670017 0.94 CES2 (0.37) CES2CES1EPHX2PKMSMN1; SMN2
Methane SCHEMBL28075888 0.89 PGR (0.35) CES2CES1EPHX2PKMNAAA
SCHEMBL5572991 0.85 TDP1 (0.38) CES2CES1SMN1; SMN2TDP1L3MBTL1
SCHEMBL2550792 0.78 LTA4H (0.38) CES2CES1EPHX2PKMSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106366762-B Active energy ray-curable ink-jet ink composition and printed article DNP (JP) 2019-11-01 CN disclosed
CN-110325601-A LIQUID COMPOSITION FOR INKJET AND INKJET RECORDING METHOD 富士胶片株式会社 2019-10-11 CN disclosed
CN-109689805-A Liquid composition for inkjet and inkjet recording method 富士胶片株式会社 2019-04-26 CN disclosed