SCHEMBL7102205

SCHEMBL7102205

CC(C)c1ccc(C2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.63
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
MAPT P10636 4/20 0.61
TP53 P04637 3/20 0.61
LMNA P02545 1/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
MAPK1 P28482 1/20 0.61
HTR2B P41595 1/20 0.61
NPC1 O15118 5/20 0.58
GAA P10253 2/20 0.58
KDM4E B2RXH2 1/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
HPGD P15428 1/20 0.58
MAOA P21397 1/20 0.58
PTGS2 P35354 1/20 0.58
MAPK10 P53779 1/20 0.53
TNKS O95271 1/20 0.53
TNKS2 Q9H2K2 1/20 0.53

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
SCHEMBL17525348 0.79 MAPT (0.71) RAB9AMEN1KMT2AMAPTTP53
Clorindione SCHEMBL43305 0.78 RAB9A (1.00) RAB9AMEN1KMT2AMAPTTP53
SCHEMBL10559578 0.78 MEN1 (1.00) RAB9AMEN1KMT2AMAPTTP53
Phenindione SCHEMBL33831 0.77 MAPT (1.00) RAB9AMEN1KMT2AMAPTTP53
Phenindione SCHEMBL29388073 0.77 MAPT (1.00) RAB9AMEN1KMT2AMAPTTP53
SCHEMBL10559114 0.74 MAPT (0.95) RAB9AMEN1KMT2AMAPTTP53
Phenindione SCHEMBL1443973 0.74 MAPT (0.95) RAB9AMEN1KMT2AMAPTTP53
Phenindione SCHEMBL6827577 0.74 MAPT (0.95) RAB9AMEN1KMT2AMAPTTP53
SCHEMBL5649473 0.74 KMT2A (1.00) RAB9AMEN1KMT2AMAPTTP53
Bromindione SCHEMBL29369456 0.74 KMT2A (1.00) RAB9AMEN1KMT2AMAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0764886-B1 Electrophotosensitive material containing a naphthoquinone derivative KYOCERA MITA CORP (JP) 2003-09-03 EP disclosed
US-5994012-A CHARGE GENERATING COMPOUND, CHARGE TRANSFER COMPOUND AND BINDER MITA INDUSTRIAL CO., LTD. (JP) 1999-11-30 US disclosed
US-5863688-A REACTING 1,3-INDANDIONE DERIVATIVE WITH A BROMOACETIC ESTER TO FORM 1,3-INDANDIONE ESTER, ISOMERIZING THE ESTER DERIVATIVE IN PRESENCE OF SODIUM HYDRIDE TO FORM NAPHTHOIC ESTER, OXIDIZING TO FORM NAPHTHOQUINONE DERIVATIVE MITA INDUSTRIAL CO., LTD (JP) 1999-01-26 US disclosed
EP-0879811-A1 Naphthoquinone derivatives and electro-photosensitive material using same MITA INDUSTRIAL CO. LTD. (JP) 1998-11-25 EP disclosed
EP-0764886-A2 Naphthoquinone derivative and electrophotosensitive material using the same MITA INDUSTRIAL CO. LTD. (JP) 1997-03-26 EP disclosed