SCHEMBL7775015

SCHEMBL7775015

N=C1OC(=O)c2ccc3c4ccc(C(=O)O)c5c(C(=O)O)ccc(c6ccc1c2c63)c54

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYMS P04818 2/20 0.53
CYP1A2 P05177 1/20 0.42
KDM4E B2RXH2 6/20 0.35
ALDH1A1 P00352 4/20 0.35
POLB P06746 4/20 0.35
RECQL P46063 3/20 0.35
CASP6 P55212 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
HSD17B10 Q99714 1/20 0.34
PARP1 P09874 1/20 0.34
HPGD P15428 2/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL3409336 0.94 TYMS (0.54) TYMSCYP1A2KDM4EALDH1A1POLB
SCHEMBL29448334 0.89 TYMS (0.65) TYMSCYP1A2KDM4EALDH1A1POLB
SCHEMBL234674 0.89 TYMS (0.65) TYMSCYP1A2KDM4EALDH1A1POLB
SCHEMBL29448335 0.89 TYMS (0.65) TYMSCYP1A2KDM4EALDH1A1POLB
Potassium SCHEMBL7487575 0.87 TYMS (0.63) TYMSCYP1A2KDM4EALDH1A1POLB
SCHEMBL22142591 0.84 TYMS (0.43) TYMSCYP1A2ALDH1A1POLBTDP1
SCHEMBL16847280 0.82 TYMS (0.56) TYMSCYP1A2KDM4EALDH1A1POLB
SCHEMBL3413891 0.82 TYMS (0.68) TYMSCYP1A2KDM4EALDH1A1POLB
Potassium Ion SCHEMBL7487570 0.81 TYMS (0.55) TYMSCYP1A2KDM4EALDH1A1POLB
SCHEMBL12593637 0.78 TYMS (0.68) TYMSCYP1A2KDM4EALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0711812-B1 Method of preparation of perylene imides, novel di-, tri-, and tetrachromophore perylene dyestuffs and their utilization CIBA SC HOLDING AG (CH) 2001-08-29 EP claimed
EP-0205980-B1 PROCESS FOR THE PREPARATION OF PERYLENE-3,4,9,10-TETRACARBOXYLIC-ACID DIANHYDRIDE HOECHST AKTIENGESELLSCHAFT (DE) 1988-12-28 EP claimed
US-4650879-A Process for the preparation of perylene-3,4,9,10-tetracarboxylic dianhydride HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-17 US claimed
JP-7089962-A None JP disclosed
JP-6184150-A None JP disclosed
US-5958129-A SPECIFIC ORGANIC PIGMENTS AND A PIGMENT DISPERSING AGENT COMPRISING AN ANTHRA(2,1,9-DEF:6,5,10)DIISOQUINOLINE DERIVATIVE; IMPROVED RHEOLOGICAL AND COLORING PROPERTIES, FOR PIGMENTING HIGH MOLECULAR WEIGHT ORGANIC MATERIALS CLARIANT GMBH (DE) 1999-09-28 US disclosed
EP-0695972-B1 Electrophotographic photoreceptor KONISHIROKU PHOTO IND (JP) 1999-06-02 EP disclosed
US-5693808-A Process for the preparation of peryleneimides, novel di-, tri- and tetrachromophoric perylene dyes and their use CIBA SPECIALTY CHEMICALS CORPORATION (US) 1997-12-02 US disclosed
US-5589309-A Electrophotographic photoreceptor containing perylenes KONICA CORPORATION (JP) 1996-12-31 US disclosed
EP-0695972-A1 Electrophotographic photoreceptor KONICA CORPORATION (JP) 1996-02-07 EP disclosed
JP-H0789962-A PERYLENE AMIDINE IMIDE DYE, AND PREPARATION AND USE THEREOF CIBA GEIGY AG 1995-04-04 JP disclosed
JP-H06184150-A INNER SALT OF PERYLENE COMPOUND, ITS PREPARATION AND ITS USE HOECHST AG 1994-07-05 JP disclosed
EP-0122442-B1 PERYLENE-3,4,9,10-TETRACARBOXYLIC-ACID-MONOANHYDRIDE-MONOIMIDE AND MONOIMIDE-AZOLIDE COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1987-11-19 EP disclosed
US-4650879-A Process for the preparation of perylene-3,4,9,10-tetracarboxylic dianhydride HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-17 US disclosed
US-4650879-A Process for the preparation of perylene-3,4,9,10-tetracarboxylic dianhydride HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-17 US disclosed
EP-0122442-A1 Perylene-3,4,9,10-tetracarboxylic-acid-monoanhydride-monoimide and monoimide-azolide compounds, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1984-10-24 EP disclosed
EP-0039482-A2 Perylene-3,4,9,10-tetracarboxylic acid monoanhydride-monoimides, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1981-11-11 EP disclosed