SCHEMBL7425833

SCHEMBL7425833

O=C(CCCCc1ccccc1)N(Cc1ccccc1)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.61
MAPT P10636 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
KDM4A O75164 1/20 0.50
KDM5A P29375 1/20 0.50
KDM4C Q9H3R0 1/20 0.50
PHF8 Q9UPP1 1/20 0.50
KDM2A Q9Y2K7 1/20 0.50
DPP4 P27487 1/20 0.47
HDAC1 Q13547 2/20 0.45
HDAC2 Q92769 2/20 0.45
KMT2A Q03164 1/20 0.45
MAPK1 P28482 2/20 0.45
HDAC3 O15379 1/20 0.45
ADRA1A P35348 1/20 0.45
HDAC4 P56524 1/20 0.45
SLC6A3 Q01959 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC10 Q969S8 1/20 0.45

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
SCHEMBL717758 0.79 ALDH1A1 (0.47) ALOX5KMT2AMAPK1SLC6A3NPC1
SCHEMBL14619236 0.78 FFAR1 (0.50) ALOX5KMT2A
SCHEMBL9836712 0.77 BCHE (0.49) ALOX5KDM4AKDM4CKMT2AMAPK1
SCHEMBL1271129 0.76 ALOX5 (1.00) ALOX5MAPTRXFP1KDM4AKDM5A
SCHEMBL5320045 0.74 PARP10 (0.44) ALOX5KMT2AMAPK1SLC6A3NPC1
SCHEMBL7129964 0.73 ALOX5 (0.66) ALOX5MAPTRXFP1KDM4AKDM5A
Beloxamide SCHEMBL636320 0.73 L3MBTL1 (0.49) ALOX5HDAC1HDAC2MAPK1HDAC3
SCHEMBL386559 0.73 ALOX5 (0.77) ALOX5MAPTRXFP1KDM4AKDM5A
SCHEMBL9835077 0.71 ALOX5 (1.00) ALOX5MAPTRXFP1KDM4AKDM5A
SCHEMBL16658765 0.71 ALOX5 (0.75) ALOX5MAPTRXFP1KDM4AKDM5A

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
EP-0773926-A1 DIFLUOROSTATONE ANTIVIRAL AGENTS MERRELL PHARMACEUTICALS INC. (US) 1997-05-21 EP disclosed
WO-1996002499-A1 DIFLUOROSTATONE ANTIVIRAL AGENTS MERRELL PHARMACEUTICALS INC. (US) 1996-02-01 WO disclosed