SCHEMBL20162498

SCHEMBL20162498

CC(C(=O)OP(=O)(O)Cl)N(OCc1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TP53 P04637 1/20 0.38
ALDH1A1 P00352 4/20 0.36
PPARG P37231 3/20 0.36
PPARA Q07869 3/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
INPPL1 O15357 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CTSK P43235 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
SCHEMBL472178 0.93 ALDH1A1 (0.38) ALDH1A1MAPTHPGDKDM4E
SCHEMBL20162506 0.93 ALDH1A1 (0.38) ALDH1A1MAPTHPGDKDM4E
SCHEMBL29794309 0.92 POLB (0.43) POLBRXFP1NPC1RAB9ATP53
SCHEMBL645087 0.89 RAB9A (0.41) POLBNPC1RAB9AALDH1A1PPARG
SCHEMBL4635211 0.88 PPARG (0.38) POLBALDH1A1PPARGPPARAMAPT
SCHEMBL20162507 0.88 PPARG (0.38) POLBALDH1A1PPARGPPARAMAPT
SCHEMBL29371149 0.83 ALDH1A1 (0.40) ALDH1A1MAPTHPGDKDM4E
SCHEMBL6555636 0.81 ALDH1A1 (0.38) ALDH1A1MAPTHPGDKDM4E
SCHEMBL7795340 0.81 SMN1; SMN2 (0.38) POLBNPC1RAB9ATP53ALDH1A1
SCHEMBL20856173 0.81 SMN1; SMN2 (0.38) POLBNPC1RAB9ATP53ALDH1A1

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 1 patent. 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