SCHEMBL8583717

SCHEMBL8583717

Cc1cccc2c(=O)cc(O)c(=O)[nH]c12

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 5/20 0.66
▸ DDO Q99489 3/20 0.66
▸ PLA2G7 Q13093 1/20 0.48
▸ TSHR P16473 2/20 0.48
▸ MAPT P10636 2/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ POLB P06746 3/20 0.47
▸ LMNA P02545 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ CHEK1 O14757 1/20 0.47
▸ TDP1 Q9NUW8 2/20 0.46
▸ AHR P35869 1/20 0.44
▸ RXFP1 Q9HBX9 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ GAA P10253 1/20 0.44

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
SCHEMBL9390027 0.81 DAO (0.68) DAODDOPLA2G7KDM4ELMNA
SCHEMBL9388997 0.80 DAO (0.66) DAODDOPLA2G7KDM4ELMNA
SCHEMBL9389416 0.80 DAO (0.66) DAODDOPLA2G7KDM4ETDP1
SCHEMBL9393346 0.80 DAO (0.49) DAODDOPLA2G7KDM4ELMNA
SCHEMBL9389395 0.80 KDM4E (0.46) DAODDOPLA2G7KDM4ETDP1
SCHEMBL9389023 0.80 DAO (0.45) DAODDOPLA2G7TSHRMAPT
SCHEMBL9389819 0.80 KIF11 (0.47) DAODDOPLA2G7TSHRKMT2A
SCHEMBL16767856 0.79 DAO (1.00) DAODDOATMKDM4ELMNA
SCHEMBL9177067 0.79 ALDH1A1 (0.62) TSHRMAPTKMT2AATMKDM4E
SCHEMBL30132108 0.79 ALDH1A1 (0.62) TSHRMAPTKMT2AATMKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5708168-A FOR TREATING OR PREVENTING NEURONAL LOSS STATE OF OREGON, ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION, ACTING FOR AND ON BEHALF OF THE OREGON HEALTH SCIENCES UNIVERSITY AND THE UNIVERSITY OF OREGON, EUGENE OREGON (US) 1998-01-13 — — US disclosed
WO-1996015112-A1 AZEPINE SYNTHESIS VIA A DIELS-ALDER REACTION ACEA PHARMACEUTICALS, INC. (US) 1996-05-23 — — WO disclosed
US-5476933-A Condensation, ring expansion STATE OF OREGON, ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION, ACTING FOR AND ON BEHALF OF THE OREGON HEALTH SCIENCES UNIVERSITY AND THE UNIVERSITY OF OREGON (US) 1995-12-19 — — US disclosed
WO-1994007500-A1 2,5-DIHYDRO-2,5-DIOXO-1H-AZEPINES AND 2,5-DIHYDRO-2-OXO-1H-AZEPINES AND THE USE THEREOF AS EXCITATORY AMINO ACID AND GLYCINE RECEPTOR ANTAGONISTS WEBER ECKARD (US) 1994-04-14 — — WO disclosed
Send feedback