SCHEMBL29604346

SCHEMBL29604346

O=P(O)(O)Oc1cccc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 8/20 0.52
INPP5A Q14642 4/20 0.52
INPP5B P32019 2/20 0.52
KDM4E B2RXH2 1/20 0.50
USP2 O75604 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50
PDE3A Q14432 1/20 0.50
HSD17B10 Q99714 1/20 0.50
SRC P12931 4/20 0.46
GPR84 Q9NQS5 1/20 0.45
AKT1 P31749 1/20 0.41
HNF4A P41235 1/20 0.40
HDAC4 P56524 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
PTPN5 P54829 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL4451434 1.00 INPPL1 (0.52) INPPL1INPP5AINPP5BKDM4EUSP2
SCHEMBL3686702 0.97 INPPL1 (0.49) INPPL1INPP5AINPP5BKDM4EUSP2
SCHEMBL28987121 0.87 GPR84 (0.46) INPPL1INPP5AINPP5BKDM4EUSP2
SCHEMBL3677648 0.87 INPPL1 (0.49) INPPL1INPP5AINPP5BKDM4EUSP2
SCHEMBL848184 0.87 INPPL1 (0.49) INPPL1INPP5AINPP5BKDM4EUSP2
SCHEMBL11481601 0.87 INPPL1 (0.42) INPPL1INPP5AINPP5BKDM4EUSP2
SCHEMBL958093 0.86 INPPL1 (0.52) INPPL1INPP5AINPP5BKDM4EUSP2
SCHEMBL30473235 0.86 KDM4E (0.46) INPPL1INPP5AINPP5BKDM4EUSP2
SCHEMBL7642864 0.86 KDM4E (0.46) INPPL1INPP5AINPP5BKDM4EUSP2
SCHEMBL4451430 0.86 GPR84 (0.40) KDM4EALDH1A1HPGDHSD17B10SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114364981-A Cellulose acetate tow with high DPF and low titania content 醋酸纤维国际有限责任公司 2022-04-15 CN disclosed
CN-114364271-A Cellulose acetate tow with low DPF and low titania content 醋酸纤维国际有限责任公司 2022-04-15 CN disclosed