SCHEMBL28948615

SCHEMBL28948615

O=C(O)C1([N+](=O)[O-])C=CC=C(c2ccccc2OCc2ccccc2)C1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 10/20 0.41
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
MCL1 Q07820 1/20 0.38
PTGER4 P35408 4/20 0.38
PTGER3 P43115 4/20 0.38
PTGER2 P43116 4/20 0.38
PPIA P62937 1/20 0.38
BRD4 O60885 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
IDO1 P14902 1/20 0.36
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP19A1 P11511 1/20 0.36

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
SCHEMBL27894247 0.73 PTGER1 (0.41) PTGER1RXRARXRBRXRGMCL1
SCHEMBL28712291 0.66 KMT2A (0.34) L3MBTL1MEN1MAPTKMT2A
SCHEMBL30008122 0.65 PTGER1 (0.64) PTGER1RXRARXRBRXRGMCL1
SCHEMBL29273233 0.65 L3MBTL1 (0.38) L3MBTL1MAPTKMT2AKDM4E
SCHEMBL26013299 0.64 MAPT (0.63) PTGER1RXRARXRBRXRGMCL1
Acetic Acid SCHEMBL5690407 0.62 RXRA (0.72) PTGER1RXRARXRBRXRGMCL1
SCHEMBL28688753 0.62 MAOA (0.30)
SCHEMBL11112000 0.62 L3MBTL1 (0.52) PTGER1RXRARXRBRXRGMCL1
SCHEMBL2305236 0.61 NPC1 (0.68) L3MBTL1MEN1KMT2AKDM4E
SCHEMBL4370622 0.61 MAPT (0.50) RXRAPPIAL3MBTL1MEN1MAPT

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-107021928-B Eltrombopag intermediate, preparation method and application thereof 常州制药厂有限公司 2022-11-18 CN claimed
CN-107021928-B Eltrombopag intermediate, preparation method and application thereof 常州制药厂有限公司 2022-11-18 CN disclosed