SCHEMBL19063571

SCHEMBL19063571

N[C@@H](Cc1c[nH]cn1)C(=O)OP(=O)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.40
LAP3 P28838 2/20 0.40
PLAU P00749 4/20 0.35
DPP7 Q9UHL4 1/20 0.35
F2 P00734 3/20 0.34
PLAT P00750 3/20 0.34
SCN9A Q15858 1/20 0.33
ELANE P08246 1/20 0.32
PLG P00747 2/20 0.32
SRC P12931 1/20 0.32
KLK8 O60259 1/20 0.32
KLK1 P06870 1/20 0.32
KLK4 Q9Y5K2 1/20 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
SCHEMBL7782151 0.83 SLC1A3 (0.37) ANPEPLAP3SCN9A
SCHEMBL7782152 0.83 SLC1A3 (0.37) ANPEPLAP3SCN9A
SCHEMBL3155213 0.77 ALPI (0.46) ANPEPLAP3
SCHEMBL729057 0.77 LTA4H (0.44) LAP3
SCHEMBL713212 0.77 LTA4H (0.44) LAP3
SCHEMBL5023637 0.76 LAP3 (0.30) ANPEPLAP3
Hydrochloric Acid SCHEMBL7273682 0.76 LTA4H (0.43) LAP3
Hydrochloric Acid SCHEMBL9515675 0.76 LTA4H (0.43) LAP3
Hydrochloric Acid SCHEMBL9515682 0.76 LTA4H (0.43) LAP3
Hydrochloric Acid SCHEMBL7273689 0.76 LTA4H (0.43) LAP3

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
US-20170190907-A1 HIGH FLOW, HIGH HEAT POLYCARBONATE COMPOSITIONS SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2017-07-06 US disclosed