SCHEMBL2438837

SCHEMBL2438837

O=[N+]([O-])c1c(Cl)cccc1OP(=O)(O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 3/20 0.49
INPP5A Q14642 3/20 0.49
INPP5B P32019 2/20 0.49
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
TLR8 Q9NR97 1/20 0.43
HPGD P15428 2/20 0.41
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
SRC P12931 4/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
PDE3A Q14432 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL2438828 1.00 INPPL1 (0.49) INPPL1INPP5AINPP5BCA1CA2
SCHEMBL845400 0.82 GPR35 (0.51) INPPL1INPP5AINPP5BCA1CA2
SCHEMBL845399 0.82 GPR35 (0.51) INPPL1INPP5AINPP5BCA1CA2
SCHEMBL4777066 0.81 INPPL1 (0.49) INPPL1INPP5AINPP5BCA1CA2
SCHEMBL14053131 0.81 INPPL1 (0.49) INPPL1INPP5AINPP5BCA1CA2
SCHEMBL12487138 0.81 INPPL1 (0.49) INPPL1INPP5AINPP5BCA1CA2
SCHEMBL11497261 0.79 HPGD (0.58) TLR8HPGDGRIN2DGRIN3BGRIN1
SCHEMBL102120 0.78 TDP1 (0.53) TLR8HPGDALDH1A1KDM4ESMN1; SMN2
SCHEMBL557291 0.75 INPPL1 (0.59) INPPL1INPP5AINPP5BHPGDSRC
SCHEMBL31272171 0.75 TLR8 (0.44) TLR8HPGDGRIN2DGRIN3BGRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2119772-B1 METHOD FOR PRODUCTION OF TRACP5b NITTO BOSEKI CO LTD (JP) 2013-11-20 EP disclosed
US-8426674-B2 Method for production of TRACP5b NITTO BOSEKI CO., LTD. (JP) 2013-04-23 US disclosed
US-20110239313-A1 METHOD FOR PRODUCTION OF TRACP5b NITTO BOSEKI CO., LTD. (JP) 2011-09-29 US disclosed
CN-101617041-B Method for production of tracp5b NITTO BOSEKI CO LTD 2011-08-10 CN disclosed
CN-101617041-A The production method of TRACP5b NITTO BOSEKI CO LTD 2009-12-30 CN disclosed
EP-2119772-A1 METHOD FOR PRODUCTION OF TRACP5b Nitto Boseki CO., LTD. (JP) 2009-11-18 EP disclosed