SCHEMBL8717848

SCHEMBL8717848

O=C1C(c2cc3ccccc3[nH]2)=Cc2cccc3cccc1c23

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.49
CHEK1 O14757 1/20 0.49
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
MAPT P10636 4/20 0.46
MAPK1 P28482 1/20 0.46
AURKA O14965 1/20 0.45
RAB9A P51151 3/20 0.42
NPC1 O15118 3/20 0.42
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 3/20 0.42
HPGD P15428 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
BRD4 O60885 3/20 0.41
CES2 O00748 1/20 0.41
BCHE P06276 1/20 0.41
CES1 P23141 1/20 0.41
MCL1 Q07820 1/20 0.41
CA2 P00918 2/20 0.40

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
SCHEMBL6626948 0.90 KDR (0.53) KDRCHEK1MEN1KMT2AMAPT
SCHEMBL8666417 0.81 KDR (0.53) KDRCHEK1MEN1KMT2AMAPT
SCHEMBL30174331 0.81 KDR (0.53) KDRCHEK1MEN1KMT2AMAPT
SCHEMBL8992187 0.75 KDR (0.53) KDRCHEK1MEN1KMT2AMAPT
SCHEMBL31682254 0.73 MAPK1 (0.61) MEN1KMT2AMAPTMAPK1ALDH1A1
SCHEMBL3713042 0.73 MAPK1 (0.61) MEN1KMT2AMAPTMAPK1ALDH1A1
SCHEMBL30968195 0.72 KDR (0.61) KDRCHEK1MEN1KMT2AMAPT
SCHEMBL22541398 0.70 CYP19A1 (0.48) KDRCHEK1MEN1KMT2AMAPT
SCHEMBL22541432 0.70 CYP19A1 (0.48) KDRCHEK1MEN1KMT2AMAPT
SCHEMBL5051826 0.70 KDR (0.68) KDRCHEK1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0502008-A1 IMPROVING STORAGE STABILITY OF OILS The Secretary of State for Defence in Her Britannic Majesty's Government of the United Kingdom of Great Britain and (GB) 1992-09-09 EP claimed
WO-1991007475-A1 IMPROVING STORAGE STABILITY OF OILS THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1991-05-30 WO claimed
EP-0570363-B1 METHOD OF TESTING OILS COMMW OF AUSTRALIA (AU) 1998-06-24 EP disclosed
US-5378632-A Detection of phenalenones and phenalanones by reaction with indole compound in presence of acid catalyst, diesel oils THE COMMONWEALTH OF AUSTRALIA (AU) 1995-01-03 US disclosed
EP-0570363-A1 METHOD OF TESTING OILS THE COMMONWEALTH OF AUSTRALIA (AU) 1993-11-24 EP disclosed
EP-0570363-A4 METHOD OF TESTING OILS. COMMW OF AUSTRALIA (AU) 1992-10-12 EP disclosed
WO-1991005242-A1 METHOD OF TESTING OILS COMMONWEALTH OF AUSTRALIA (AU) 1991-04-18 WO disclosed