SCHEMBL4635211

SCHEMBL4635211

C[C@H](C(=O)OP(=O)(O)Cl)N(OCc1ccccc1)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.38
PPARA Q07869 1/20 0.38
SLC6A3 Q01959 1/20 0.36
MEN1 O00255 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
SPPL2A Q8TCT8 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ELANE P08246 1/20 0.34
POLB P06746 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ATM Q13315 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM3 P20309 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
SCHEMBL20162507 1.00 PPARG (0.38) PPARGPPARASLC6A3MEN1CYP2D6
SCHEMBL20162498 0.88 POLB (0.42) PPARGPPARAALDH1A1MAPTHPGD
SCHEMBL472178 0.88 ALDH1A1 (0.38) ALDH1A1MAPTHPGDKDM4EELANE
SCHEMBL20162506 0.88 ALDH1A1 (0.38) ALDH1A1MAPTHPGDKDM4EELANE
SCHEMBL645087 0.84 RAB9A (0.41) PPARGPPARAMEN1KMT2AALDH1A1
SCHEMBL29794309 0.80 POLB (0.43) PPARGPPARAALDH1A1MAPTHPGD
SCHEMBL29371149 0.78 ALDH1A1 (0.40) ALDH1A1MAPTHPGDKDM4EELANE
SCHEMBL10004685 0.78 ALDH1A1 (0.40) ALDH1A1MAPTHPGDKDM4EELANE
SCHEMBL472191 0.77 ALDH1A1 (0.38) KMT2AALDH1A1MAPTHPGDKDM4E
SCHEMBL6555636 0.76 ALDH1A1 (0.38) ALDH1A1MAPTHPGDKDM4EELANE

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
EP-1928475-B1 ANTIVIRAL PHOSPHORAMIDATES OF 4'-C-AZIDO-SUBSTITUTED PRONUCLEOTIDES RIBOSCIENCE LLC (US) 2018-05-23 EP disclosed
EP-1928475-A2 ANTIVIRAL PHOSPHORAMIDATES OF 4'-SUBSTITUTED PRONUCLEOTIDES F.HOFFMANN-LA ROCHE AG (CH) 2008-06-11 EP disclosed
WO-2007020193-A2 ANTIVIRAL PHOSPHORAMIDATES OF 4 ' -SUBSTITUTED PRONUCLEOTIDES F. HOFFMANN-LA ROCHE AG (CH) 2007-02-22 WO disclosed