SCHEMBL20162548

SCHEMBL20162548

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

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 4/20 0.33
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
MAPT P10636 4/20 0.33
RECQL P46063 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
STAT6 P42226 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL7030455 1.00 KDM4E (0.34) KDM4ETDP1ALDH1A1MEN1KMT2A
SCHEMBL382026 0.85 KDM4E (0.36) KDM4ETDP1ALDH1A1MEN1KMT2A
SCHEMBL22321965 0.85 KDM4E (0.36) KDM4ETDP1ALDH1A1MEN1KMT2A
SCHEMBL779563 0.85 SMN1; SMN2 (0.37) KDM4ETDP1ALDH1A1MEN1KMT2A
SCHEMBL20162518 0.84 KDM4E (0.38) KDM4ETDP1ALDH1A1MEN1KMT2A
SCHEMBL781267 0.84 KDM4E (0.38) KDM4ETDP1ALDH1A1MEN1KMT2A
SCHEMBL20856173 0.82 SMN1; SMN2 (0.38) KDM4ETDP1ALDH1A1MEN1KMT2A
SCHEMBL7795340 0.82 SMN1; SMN2 (0.38) KDM4ETDP1ALDH1A1MEN1KMT2A
SCHEMBL472185 0.81 SIGMAR1 (0.33) KDM4EALDH1A1KMT2ASMN1; SMN2
SCHEMBL20162506 0.80 ALDH1A1 (0.38) KDM4EALDH1A1MAPTLMNA

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