SCHEMBL7598397

SCHEMBL7598397

C=CCCCCCCCCOc1ccc(O)c(C=C(N)CCC(N)C=C(C=O)c2ccccc2)c1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAOB P27338 2/20 0.33
ALDH2 P05091 1/20 0.33
MAOA P21397 1/20 0.33
LSS P48449 3/20 0.32
SLC10A2 Q12908 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
PTPN1 P18031 2/20 0.30
BCHE P06276 1/20 0.30
ACHE P22303 1/20 0.30

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
SCHEMBL7597225 0.89 PRSS1 (0.32)
SCHEMBL7598392 0.71 ALDH1A1 (0.35) ALDH1A1L3MBTL1MAOBALDH2MAOA
SCHEMBL7600418 0.70 ERN1 (0.50) ALDH1A1L3MBTL1MAOBALDH2MAOA
SCHEMBL7598088 0.70 ERN1 (0.50) ALDH1A1L3MBTL1MAOBALDH2MAOA
SCHEMBL8602327 0.65 MAOB (0.51) ALDH1A1L3MBTL1MAOBALDH2MAOA
SCHEMBL7600620 0.64 L3MBTL1 (0.56) ALDH1A1L3MBTL1MAOALSSACHE
SCHEMBL7600626 0.64 L3MBTL1 (0.56) ALDH1A1L3MBTL1MAOALSSACHE
SCHEMBL7599962 0.63 CA2 (0.44) ALDH1A1L3MBTL1MAOBALDH2MAOA
SCHEMBL7599960 0.63 CA2 (0.44) ALDH1A1L3MBTL1MAOBALDH2MAOA
SCHEMBL7600443 0.63 CA2 (0.44) ALDH1A1L3MBTL1MAOBALDH2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0927155-B1 METAL-CONTAINING SIDE CHAIN LIQUID CRYSTAL POLYMERS QINETIQ LTD (GB) 2002-11-20 EP disclosed
US-6184322-B1 USED IN DISPLAY TECHNOLOGY, THIN FILM MAGNETIC MATERIALS FOR USE IN DATA STORAGE, LUBRICANTS AND ANISOTROPICALLY SUPPORTED CATALYSTS THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 2001-02-06 US disclosed
EP-0927155-A1 METAL-CONTAINING SIDE CHAIN LIQUID CRYSTAL POLYMERS THE SECRETARY OF STATE FOR DEFENCE (GB) 1999-07-07 EP disclosed
WO-1997049671-A1 METAL-CONTAINING SIDE CHAIN LIQUID CRYSTAL POLYMERS THE SECRETARY OF STATE FOR DEFENCE (GB) 1997-12-31 WO disclosed