SCHEMBL10901422

SCHEMBL10901422

Cc1cccc(-c2ccccc2)c1OP(=O)(O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 3/20 0.46
INPP5A Q14642 2/20 0.46
INPP5B P32019 1/20 0.46
SRC P12931 3/20 0.44
SCN8A Q9UQD0 1/20 0.43
KMT2A Q03164 2/20 0.41
GPR84 Q9NQS5 1/20 0.41
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
AKT1 P31749 1/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
HIF1A Q16665 1/20 0.40
PDCD1 Q15116 1/20 0.39

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
SCHEMBL4127170 0.89 SCN8A (0.42) SCN8AKMT2AGPR84ALDH1A1SMN1; SMN2
SCHEMBL27780601 0.88 INPPL1 (0.53) INPPL1INPP5AINPP5BSRCGPR84
SCHEMBL4127149 0.86 SCN8A (0.40) SCN8AKMT2AGPR84ALDH1A1SMN1; SMN2
SCHEMBL4126771 0.84 GPR84 (0.40) SCN8AKMT2AGPR84ALDH1A1SMN1; SMN2
SCHEMBL4124703 0.84 SCN8A (0.42) SCN8AKMT2AGPR84ALDH1A1SMN1; SMN2
SCHEMBL4131609 0.83 SCN8A (0.39) SCN8AKMT2AGPR84ALDH1A1SMN1; SMN2
SCHEMBL4126327 0.82 LMNA (0.40) SCN8AKMT2AGPR84ALDH1A1SMN1; SMN2
SCHEMBL5512636 0.82 SRC (0.43) INPPL1INPP5AINPP5BSRCGPR84
SCHEMBL2220467 0.82 INPPL1 (0.59) INPPL1INPP5AINPP5BSRCKMT2A
Toluene SCHEMBL30760635 0.81 INPPL1 (0.50) INPPL1INPP5AINPP5BSRCKMT2A

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
CN-100516172-C Flame retardant composition ASAHI CHEMICAL IND (JP) 2009-07-22 CN disclosed
CN-1875084-A Flame retardant composition ASAHI CHEMICAL CORP (JP) 2006-12-06 CN disclosed
WO-1986006737-A1 COATING MATERIAL FOR FLEXIBLE SUBSTRATES, ITS USE AND PROCESS FOR PRODUCING A PROTECTIVE COATING BGB-GESELLSCHAFT REINMAR JOHN, RAINER-LEO MEYER & (DE) 1986-11-20 WO disclosed