SCHEMBL28054575

SCHEMBL28054575

CC1(C)CO[P](O)(Oc2ccccc2-c2ccccc2)OC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.36
HRH1 P35367 1/20 0.36
HTR7 P34969 1/20 0.36
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 6/20 0.35
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SCN1A P35498 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35
HTT P42858 2/20 0.34
BLM P54132 1/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 2/20 0.34
TP53 P04637 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL4140078 0.84 POLB (0.35) POLBHRH1HTR7ADRA2AADRA2B
SCHEMBL28060705 0.78 CYP1A2 (0.36) TDP1KDM4ESMN1; SMN2GAAMAPK1
SCHEMBL28060712 0.68 CYP1A2 (0.42) TDP1L3MBTL1KDM4EALDH1A1MAPK1
SCHEMBL14774812 0.66 KDM4E (0.37) POLBHRH1ADRA2AADRA2BADRA2C
SCHEMBL27803972 0.66 HTR7 (0.47) POLBHTR7TDP1L3MBTL1KDM4E
SCHEMBL17667241 0.65 ADRA2A (0.44) HRH1HTR7ADRA2AADRA2BADRA2C
SCHEMBL30695977 0.65 DHFR (0.47) POLBHTR7TDP1L3MBTL1KDM4E
SCHEMBL28958344 0.65 MAPK1 (0.47) HRH1HTR7ADRA2AADRA2BADRA2C
Methyl Alcohol SCHEMBL28372647 0.63 ALDH1A1 (0.55) HTR7TDP1L3MBTL1KDM4EALDH1A1
SCHEMBL8733676 0.63 MAPK1 (0.60) POLBHTR7TDP1L3MBTL1KDM4E

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-108178943-B Flame-retardant coating agent for vehicle seat and method for producing flame-retardant vehicle seat material 日华化学株式会社 2020-04-21 CN disclosed
CN-105829466-A Flame-retardant coating agent for vehicle seat and method for producing flame-retardant vehicle seat material 日华化学株式会社 2016-08-03 CN disclosed
CN-102884069-B Phosphate preparations DAIHACHI CHEMICAL INDUSTRY CO.,LTD. (JP) 2016-03-23 CN disclosed