SCHEMBL28048468

SCHEMBL28048468

CCCCCCCCCCc1ccc(C(=O)OP(=O)(O)c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.51
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
RARA P10276 1/20 0.51
MAPT P10636 1/20 0.51
MTOR P42345 1/20 0.51
KMT2A Q03164 1/20 0.51
PLK1 P53350 3/20 0.50
PLK3 Q9H4B4 3/20 0.50
ENPP2 Q13822 1/20 0.50
CETP P11597 3/20 0.49
PLA2G1B P04054 3/20 0.48
ATG4B Q9Y4P1 3/20 0.48
TRPV1 Q8NER1 1/20 0.48
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48
CYP1A2 P05177 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL16377267 0.80 RARB (0.55) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL10626442 0.79 RARB (0.60) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL9698325 0.79 RARB (0.60) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL27712415 0.79 RARB (0.60) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL16332181 0.79 RARB (0.54) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL10804980 0.78 RARB (0.59) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL28709353 0.78 PLK1 (0.57) RARBMEN1ALDH1A1RARAMAPT
Ammonia Solution, Strong SCHEMBL28944620 0.77 RARB (0.55) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL28297577 0.77 RARB (0.51) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL10783756 0.77 RARB (0.57) RARBMEN1ALDH1A1RARAMAPT

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-110204961-A The industrial deinking of printing ink composition 西康制造有限公司 2019-09-06 CN disclosed
CN-105339445-B Industrial deinking of ink compositions 西康制造有限公司 2019-07-05 CN disclosed
CN-105339445-A Industrial deinking of ink compositions XEIKON IP BV 2016-02-17 CN disclosed