SCHEMBL8600436

SCHEMBL8600436

O=C1C=Cc2c(F)cccc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 5/20 0.49
MAPT P10636 5/20 0.47
PTPN1 P18031 5/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 4/20 0.47
IDO1 P14902 3/20 0.47
HPGD P15428 3/20 0.47
RECQL P46063 3/20 0.47
CES1 P23141 3/20 0.47
THRB P10828 2/20 0.47
ALOX15 P16050 2/20 0.47
HSD17B10 Q99714 2/20 0.47
POLB P06746 2/20 0.47
PTPN22 Q9Y2R2 2/20 0.47
BCHE P06276 2/20 0.47
LMNA P02545 1/20 0.47
PKM P14618 1/20 0.47
ACHE P22303 1/20 0.47

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
SCHEMBL29096424 0.87 IDO1 (0.50) PTPRCMAPTPTPN1MEN1KMT2A
SCHEMBL31504492 0.87 IDO1 (0.50) PTPRCMAPTPTPN1MEN1KMT2A
SCHEMBL10409093 0.75 MAPT (0.53) PTPRCMAPTPTPN1MEN1KMT2A
SCHEMBL5886509 0.75 PTPRC (0.49) PTPRCMAPTPTPN1MEN1KMT2A
SCHEMBL5886239 0.75 PTPRC (0.53) PTPRCMAPTPTPN1MEN1KMT2A
SCHEMBL30496126 0.75 MAPT (0.53) PTPRCMAPTPTPN1MEN1KMT2A
SCHEMBL5886422 0.75 PTPRC (0.49) PTPRCMAPTPTPN1MEN1KMT2A
SCHEMBL13445016 0.75 PTPRC (0.49) PTPRCMAPTPTPN1MEN1KMT2A
SCHEMBL27921312 0.72 PTPRC (0.46) PTPRCMAPTPTPN1MEN1KMT2A
SCHEMBL7899015 0.72 PTPRC (0.46) PTPRCMAPTPTPN1MEN1KMT2A

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-0876368-A1 USE OF MONO- OR DIKETONE TETRACYCLIC DERIVATIVES, RESULTING NOVEL COMPOUNDS AND THERAPEUTICAL USE THEREOF LABORATOIRE INNOTHERA Société Anonyme (FR) 1998-11-11 EP claimed
WO-1997021709-A1 USE OF MONO- OR DIKETONE TETRACYCLIC DERIVATIVES, RESULTING NOVEL COMPOUNDS AND THERAPEUTICAL USE THEREOF LABORATOIRE INNOTHERA (FR) 1997-06-19 WO claimed
EP-0876368-A1 USE OF MONO- OR DIKETONE TETRACYCLIC DERIVATIVES, RESULTING NOVEL COMPOUNDS AND THERAPEUTICAL USE THEREOF LABORATOIRE INNOTHERA Société Anonyme (FR) 1998-11-11 EP disclosed
WO-1997021709-A1 USE OF MONO- OR DIKETONE TETRACYCLIC DERIVATIVES, RESULTING NOVEL COMPOUNDS AND THERAPEUTICAL USE THEREOF LABORATOIRE INNOTHERA (FR) 1997-06-19 WO disclosed