SCHEMBL20107845

SCHEMBL20107845

Nc1ccc(OP(=O)(O)O)c(F)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 12/20 0.52
INPP5A Q14642 6/20 0.48
AKT1 P31749 1/20 0.48
INPP5B P32019 2/20 0.48
SRC P12931 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
USP2 O75604 1/20 0.37
HPGD P15428 1/20 0.37
PDE3A Q14432 1/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
AKR1B1 P15121 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
SCHEMBL29188146 0.81 INPPL1 (0.52) INPPL1INPP5AAKT1INPP5BSRC
SCHEMBL25269363 0.81 INPPL1 (0.55) INPPL1INPP5AAKT1INPP5BSRC
SCHEMBL14274128 0.78 INPPL1 (0.52) INPPL1INPP5AAKT1INPP5BSRC
SCHEMBL17533109 0.77 INPPL1 (0.44) INPPL1INPP5AAKT1INPP5BSRC
SCHEMBL1771611 0.77 INPPL1 (0.52) INPPL1INPP5AAKT1INPP5BSRC
SCHEMBL30433430 0.77 INPPL1 (0.52) INPPL1INPP5AAKT1INPP5BSRC
SCHEMBL20107983 0.76 INPPL1 (0.50) INPPL1INPP5AAKT1INPP5BSRC
SCHEMBL21407723 0.75 INPPL1 (0.49) INPPL1INPP5AAKT1INPP5BRAB9A
SCHEMBL21407737 0.75 SRC (0.51) INPPL1INPP5AAKT1INPP5BSRC
SCHEMBL12518721 0.74 ALDH1A1 (0.34) ALDH1A1KDM4EUSP2LMNAMAPK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180180567-A1 MICROWELL ELECTRODE AND METHOD FOR ANALYSIS OF A CHEMICAL SUBSTANCE BGI SHENZHEN (CN) 2018-06-28 US disclosed
US-20180180567-A1 MICROWELL ELECTRODE AND METHOD FOR ANALYSIS OF A CHEMICAL SUBSTANCE BGI SHENZHEN (CN) 2018-06-28 US disclosed
EP-3315461-A1 MICRO-POROUS ELECTRODE AND METHOD FOR ANALYSIS OF CHEMICAL SUBSTANCES BGI Shenzhen (CN) 2018-05-02 EP disclosed