SCHEMBL29243294

SCHEMBL29243294

O=P(O)(O)Oc1c(Cl)c(Cl)cc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 4/20 0.46
INPPL1 O15357 6/20 0.41
INPP5A Q14642 5/20 0.41
INPP5B P32019 2/20 0.41
SRC P12931 2/20 0.39
AKT1 P31749 1/20 0.39
PTPN1 P18031 1/20 0.36
CYP2A6 P11509 1/20 0.35
ERN1 O75460 1/20 0.35
ACP3 P15309 2/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
HSD17B10 Q99714 2/20 0.33
USP2 O75604 1/20 0.33
PDE3A Q14432 1/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
GLA P06280 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL27610136 0.83 GPR84 (0.65) GPR84INPPL1INPP5AINPP5BSRC
SCHEMBL25273082 0.80 CYP2A6 (0.46) GPR84INPPL1INPP5AINPP5BSRC
SCHEMBL9279307 0.77 HPGD (0.39) GPR84CYP2A6ERN1KDM4EALDH1A1
SCHEMBL25278049 0.76 SRC (0.42) GPR84INPPL1INPP5AINPP5BSRC
SCHEMBL398680 0.75 MEN1 (0.42) GPR84CYP2A6ERN1KDM4EALDH1A1
SCHEMBL554382 0.75 MEN1 (0.48) INPPL1INPP5AINPP5BSRCAKT1
SCHEMBL3715719 0.73 INPPL1 (0.43) GPR84INPPL1INPP5AINPP5BSRC
SCHEMBL3714302 0.71 PTPN22 (0.47) GPR84INPPL1INPP5AINPP5BSRC
SCHEMBL4204715 0.71 ERN1 (0.45) GPR84INPPL1INPP5AINPP5BSRC
SCHEMBL4190095 0.71 ERN1 (0.67) GPR84INPPL1INPP5AINPP5BSRC

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-118580481-A Phosphate modified flame-retardant aromatic polycarbonate material and preparation method thereof 江苏仟乙科技有限公司 2024-09-03 CN disclosed
CN-114008058-B Prodrugs of CDK inhibitors for the treatment of cancer 润佳(苏州)医药科技有限公司 2024-07-05 CN disclosed