SCHEMBL8230711

SCHEMBL8230711

O=C(O)[C@@H](CO)NC(P)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.41
CYP2D6 P10635 1/20 0.41
SRC P12931 1/20 0.41
LMNA P02545 2/20 0.39
MAPK1 P28482 1/20 0.39
TGFBR1 P36897 1/20 0.39
NAALAD2 Q9Y3Q0 1/20 0.39
POLB P06746 1/20 0.38
APAF1 O14727 1/20 0.38
ACE2 Q9BYF1 1/20 0.37

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
SCHEMBL8621288 0.81 ALDH1A1 (0.44) MMECYP2D6SRCLMNAMAPK1
SCHEMBL8621292 0.81 ALDH1A1 (0.44) MMECYP2D6SRCLMNAMAPK1
SCHEMBL29001941 0.81 ALDH1A1 (0.44) MMECYP2D6SRCLMNAMAPK1
SCHEMBL28700643 0.80 LMNA (0.45) MMECYP2D6SRCLMNAMAPK1
SCHEMBL594168 0.73 GSR (0.44) MMECYP2D6SRCNAALAD2
SCHEMBL8575470 0.71 TGFBR1 (0.58) MMETGFBR1NAALAD2
SCHEMBL7222907 0.70 MME (0.68) MMEACE2
SCHEMBL344919 0.69 MME (0.45) MMELMNAMAPK1POLB
SCHEMBL344918 0.69 MME (0.45) MMELMNAMAPK1POLB
SCHEMBL3488827 0.69 MME (0.45) MMELMNAMAPK1POLB

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
WO-2007137080-A2 COMPOUNDS AND COMPOSITIONS AS CHANNEL ACTIVATING PROTEASE INHIBITORS IRM LLC (BM) 2007-11-29 WO disclosed