SCHEMBL20162506

SCHEMBL20162506

CC(C(=O)OP(=O)(O)Cl)N(OCc1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
TSHR P16473 1/20 0.38
CETP P11597 3/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ELANE P08246 1/20 0.36
FOLH1 Q04609 1/20 0.36
HSD17B10 Q99714 1/20 0.35
ABCB1 P08183 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 1.00 ALDH1A1 (0.38) ALDH1A1TSHRCETPMAPTHPGD
SCHEMBL20162498 0.93 POLB (0.42) ALDH1A1MAPTHPGDKDM4E
SCHEMBL645087 0.91 RAB9A (0.41) ALDH1A1TSHRLMNAL3MBTL1ELANE
SCHEMBL29371149 0.90 ALDH1A1 (0.40) ALDH1A1TSHRCETPMAPTHPGD
SCHEMBL4635211 0.88 PPARG (0.38) ALDH1A1MAPTHPGDKDM4EELANE
SCHEMBL20162507 0.88 PPARG (0.38) ALDH1A1MAPTHPGDKDM4EELANE
SCHEMBL6555636 0.88 ALDH1A1 (0.38) ALDH1A1TSHRCETPMAPTHPGD
SCHEMBL7795340 0.87 SMN1; SMN2 (0.38) ALDH1A1TSHRMAPTLMNAKDM4E
SCHEMBL20856173 0.87 SMN1; SMN2 (0.38) ALDH1A1TSHRMAPTLMNAKDM4E
SCHEMBL20856237 0.86 HSD17B10 (0.40) HSD17B10

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