SCHEMBL9640935

SCHEMBL9640935

c1ccc(-c2ccc3c(c2)Cc2cc(-c4ccccc4)ccc2O3)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
TDP2 O95551 1/20 0.43
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 2/20 0.42
GAA P10253 2/20 0.42
KMT2A Q03164 2/20 0.42
HRH3 Q9Y5N1 2/20 0.40
ALOX5 P09917 1/20 0.39
PARP10 Q53GL7 1/20 0.39
PARP11 Q9NR21 1/20 0.39
PTGS2 P35354 1/20 0.39
ACSL1 P33121 1/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
PGR P06401 1/20 0.38
KDM1A O60341 2/20 0.38

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
SCHEMBL5705225 0.94 MAOA (0.63) MAOAMAOBTDP2CA12CA9
Xanthene SCHEMBL20969988 0.80 MAOA (0.81) MAOAMAOBKDM4EGAAALOX5
SCHEMBL7112415 0.77 TDP2 (0.40) MAOAMAOBTDP2ALOX5PARP10
SCHEMBL28301739 0.77 MAOA (0.55) MAOAMAOBTDP2GAAACSL1
SCHEMBL21898357 0.76 MAOA (0.49) MAOAMAOBKDM4EMEN1KMT2A
SCHEMBL14033226 0.76 PARP10 (0.44) MAOAMAOBTDP2KDM4EPARP10
SCHEMBL1482920 0.76 TDP2 (0.61) TDP2KDM4EMEN1KMT2AALOX5
SCHEMBL29569358 0.76 TDP2 (0.61) TDP2KDM4EMEN1KMT2AALOX5
SCHEMBL3136254 0.76 TDP2 (0.61) TDP2KDM4EMEN1KMT2AALOX5
SCHEMBL5713325 0.76 TDP2 (0.52) MAOATDP2KDM4EMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0335237-B1 INKS FOR INK-JET PRINTING BASF Aktiengesellschaft (DE) 1992-09-23 EP claimed
EP-0335237-A2 Inks for ink-jet printing BASF Aktiengesellschaft (DE) 1989-10-04 EP claimed
JP-1289879-A None JP disclosed
EP-0335237-B1 INKS FOR INK-JET PRINTING BASF Aktiengesellschaft (DE) 1992-09-23 EP disclosed
EP-0335237-A3 INKS FOR INK-JET PRINTING BASF Aktiengesellschaft (DE) 1991-03-06 EP disclosed
JP-H01289879-A INK FOR INK-JET RECORDING METHOD BASF AG 1989-11-21 JP disclosed
EP-0335237-A2 Inks for ink-jet printing BASF Aktiengesellschaft (DE) 1989-10-04 EP disclosed
EP-0335237-A2 Inks for ink-jet printing BASF Aktiengesellschaft (DE) 1989-10-04 EP disclosed