SCHEMBL8909384

SCHEMBL8909384

O=C1c2ccccc2C(=O)c2c1ccc1c2C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.48
MAPK1 P28482 8/20 0.48
ALDH1A1 P00352 8/20 0.48
KMT2A Q03164 7/20 0.48
MAOA P21397 6/20 0.48
MEN1 O00255 6/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
CYP3A4 P08684 3/20 0.48
ALOX12 P18054 2/20 0.48
MCL1 Q07820 2/20 0.48
RECQL P46063 2/20 0.48
MAOB P27338 1/20 0.48
KDM4E B2RXH2 1/20 0.48
BCL2 P10415 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
APEX1 P27695 1/20 0.48
DAPK1 P53355 1/20 0.48
CYP1B1 Q16678 1/20 0.48
HSD17B10 Q99714 1/20 0.48

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
SCHEMBL30184093 1.00 MAPT (0.48) MAPTMAPK1ALDH1A1KMT2AMAOA
SCHEMBL4283299 0.82 ALDH1A1 (0.47) MAPTMAPK1ALDH1A1KMT2AMAOA
SCHEMBL29505881 0.79 CES1 (0.55) MAPTMAPK1ALDH1A1KMT2AMAOA
SCHEMBL57012 0.79 CES1 (0.55) MAPTMAPK1ALDH1A1KMT2AMAOA
SCHEMBL29749956 0.79 CES1 (0.55) MAPTMAPK1ALDH1A1KMT2AMAOA
Water SCHEMBL11224287 0.78 CES1 (0.54) MAPTMAPK1ALDH1A1KMT2AMAOA
SCHEMBL17029061 0.77 MAOA (0.50) MAPTMAPK1ALDH1A1KMT2AMAOA
SCHEMBL31065701 0.76 MAOA (0.53) MAPTMAPK1ALDH1A1KMT2AMAOA
SCHEMBL9149950 0.74 CES1 (0.50) MAPTMAPK1ALDH1A1KMT2AMAOA
SCHEMBL7525372 0.72 AKR1B1 (0.63) MAPTMAPK1ALDH1A1KMT2AMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117581407-A Nonaqueous electrolyte containing anthraquinone compound and secondary battery comprising same 爱沃特高能化工株式会社 2024-02-20 CN disclosed
US-5677471-A Process for the preparation of quinone derivative EISAI CHEMICAL CO., LTD. (JP) 1997-10-14 US disclosed
US-5476955-A Process for the preparation of a quinone derivative EISAI CHEMICAL CO., LTD. (JP) 1995-12-19 US disclosed
US-5412124-A Preparation process of naphthoquinone derivative and intermediate for the preparation thereof EISAI CHEMICAL CO., LTD. (JP) 1995-05-02 US disclosed
EP-0613877-A1 Preparation process of quinone derivative and intermediate for the preparation thereof EISAI CHEMICAL CO., LTD. (JP) 1994-09-07 EP disclosed
EP-0132741-A1 Process for the production of compounds of the vitamin K series and of ubichinones, and intermediate compounds F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1985-02-13 EP disclosed