SCHEMBL20162538

SCHEMBL20162538

CCON(c1ccccc1)C(C(=O)OP(=O)(O)Cl)C(C)CC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
LMNA P02545 2/20 0.35
TP53 P04637 1/20 0.35
KDM4E B2RXH2 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CHRM2 P08172 2/20 0.34
CHRM4 P08173 2/20 0.34
CHRM1 P11229 2/20 0.34
CHRM3 P20309 2/20 0.34
TSHR P16473 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 2/20 0.32
HSD17B10 Q99714 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
POLB P06746 2/20 0.32

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
SCHEMBL20856173 0.85 SMN1; SMN2 (0.38) ALDH1A1SMN1; SMN2LMNATP53KDM4E
SCHEMBL7795340 0.85 SMN1; SMN2 (0.38) ALDH1A1SMN1; SMN2LMNATP53KDM4E
SCHEMBL20856249 0.76 POLB (0.33) ALDH1A1SMN1; SMN2LMNATP53TSHR
SCHEMBL472178 0.73 ALDH1A1 (0.38) ALDH1A1LMNAKDM4ETSHRMAPT
SCHEMBL20162506 0.73 ALDH1A1 (0.38) ALDH1A1LMNAKDM4ETSHRMAPT
SCHEMBL779563 0.73 SMN1; SMN2 (0.37) ALDH1A1SMN1; SMN2LMNATP53KDM4E
SCHEMBL22321965 0.73 KDM4E (0.36) ALDH1A1SMN1; SMN2LMNATP53KDM4E
SCHEMBL382026 0.73 KDM4E (0.36) ALDH1A1SMN1; SMN2LMNATP53KDM4E
SCHEMBL10004648 0.72 ALOX15 (0.39) ALDH1A1SMN1; SMN2LMNATP53KDM4E
SCHEMBL17786771 0.72 TSHR (0.39) ALDH1A1SMN1; SMN2LMNATP53KDM4E

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