SCHEMBL7964993

SCHEMBL7964993

COc1ccc(OC)c2c1C(=O)NC2=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
CA7 P43166 3/20 0.56
CA9 Q16790 3/20 0.56
KDM4E B2RXH2 5/20 0.52
MAPT P10636 3/20 0.52
MAPK1 P28482 2/20 0.52
RAB9A P51151 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
S1PR4 O95977 1/20 0.52
HSP90AA1 P07900 1/20 0.52
G6PD P11413 1/20 0.52
S1PR1 P21453 1/20 0.52
OPRK1 P41145 1/20 0.52
HTT P42858 1/20 0.52
CACNA1B Q00975 1/20 0.52
APBA1 Q02410 1/20 0.52
MCL1 Q07820 1/20 0.52
APOBEC3G Q9HC16 1/20 0.52
TLR9 Q9NR96 1/20 0.52

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
SCHEMBL29378366 0.79 TOP1 (0.55) CA1CA2CA7CA9KDM4E
SCHEMBL384815 0.79 TOP1 (0.55) CA1CA2CA7CA9KDM4E
SCHEMBL6157005 0.78 RAB9A (0.53) KDM4ERAB9AALDH1A1HPGDHSD17B10
SCHEMBL11428923 0.76 GSK3B (0.45) CA1CA2CA7CA9KDM4E
SCHEMBL2306305 0.76 KDM4E (0.48) CA1CA2CA7CA9KDM4E
SCHEMBL11134106 0.76 MAPT (0.73) CA1CA2CA7CA9KDM4E
SCHEMBL28678417 0.75 PARP1 (0.58) CA1CA2CA7CA9KDM4E
SCHEMBL20504930 0.75 L3MBTL1 (0.43) CA1CA2CA7CA9KDM4E
SCHEMBL24317498 0.72 MAPT (0.43) CA1CA2CA7CA9KDM4E
SCHEMBL358094 0.72 TOP1 (0.63) CA1CA2CA7CA9KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6307147-B1 PHTHALOCYANINE DYES; POLYMORPHISM RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2001-10-23 US disclosed
US-6051702-A PHTHALOCYANINE COMPOUNDS USED AS DYES FOR APPLICATIONS AS SOLAR ORGANIC PHOTOVOLTAIC) MATERIALS AND AS ELECTROPHOTOGRAPHIC (XEROGRAPHIC) ORGANIC PHOTOCONDUCTOR MATERAIALS RUTGERS, THE UNIVERSITY OF NEW JERSEY (US) 2000-04-18 US disclosed
US-4144072-A CONTAINING A PHTHALAZINONE AND A PHTHALIMIDE FUJI PHOTO FILM CO., LTD. (JP) 1979-03-13 US disclosed