SCHEMBL8004072

SCHEMBL8004072

O=C(O)Cc1cccc2c1CCC2=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.54
GAA P10253 1/20 0.54
AKR1B1 P15121 2/20 0.47
TDP1 Q9NUW8 1/20 0.43
DUSP3 P51452 1/20 0.42
PTPN5 P54829 1/20 0.42
PTPN11 Q06124 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.42
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 1/20 0.38
MAPT P10636 1/20 0.38
ABCB1 P08183 2/20 0.37
MRGPRX4 Q96LA9 1/20 0.37

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
SCHEMBL7846530 0.81 ALDH1A1 (0.52) ALDH1A1GAAKDM4EMAPTABCB1
SCHEMBL9456120 0.80 ALDH1A1 (0.48) ALDH1A1GAAAKR1B1KDM4EMAPT
SCHEMBL9456183 0.80 ALDH1A1 (0.51) ALDH1A1GAAAKR1B1KDM4EABCB1
SCHEMBL1151568 0.78 ALDH1A1 (0.59) ALDH1A1GAAKDM4EABCB1
SCHEMBL7812602 0.77 ALDH1A1 (0.50) ALDH1A1GAAKDM4EMAPTABCB1
SCHEMBL11631564 0.76 ALDH1A1 (0.47) ALDH1A1GAACTDSP1CYP1A2MRGPRX4
SCHEMBL6322288 0.75 AKR1B1 (0.48) GAAAKR1B1TDP1DUSP3PTPN5
SCHEMBL9517001 0.75 AKR1B1 (0.43) ALDH1A1AKR1B1TDP1DUSP3PTPN5
SCHEMBL7819409 0.75 ALDH1A1 (0.49) ALDH1A1GAAGRIN2DGRIN3BGRIN1
SCHEMBL569778 0.74 ALDH1A1 (0.47) ALDH1A1GAAMAPTMRGPRX4

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
US-6100264-A 5H, 10H-imidazo [1,2-A] indeno [1,2-E] pyrazin-4-one derivatives, their preparation, their intermediates and medicaments containing them RHONE-POULENC RORER, S.A. (FR) 2000-08-08 US disclosed
US-6057454-A USEFUL FOR TREATING OR PREVENTING ALL ISCHAEMIAS (SUCH AS FOCAL OR GLOBAL ISCHAEMIA) RESULTING FROM CEREBROVASCULAR DISORDERS RHONE-POULENC RORER S.A. (FR) 2000-05-02 US disclosed
US-5990108-A USEFUL AS ANTAGONISTS OF THE ALPHA-AMINO-3-HYDROXY-5-METHYL-4-ISOXAZOLEPROPIONIC ACID (AMPA) RECEPTOR, ALSO KNOWN AS THE QUISQUALATE RECEPTOR, AND AS ANTAGONISTS OF THE N-METHYL-D-ASPARTATE (NMDA) RECEPTOR RHONE POULENC RORER S.A. (FR) 1999-11-23 US disclosed
US-5902803-A 5H,10H-imidazo 1,2-a!indeno 1,2-e!pyrazin-4-one derivatives, preparation thereof, and drugs containing said derivatives RHONE-POULENC RORER S.A. (FR) 1999-05-11 US disclosed
CN-1207102-A 5h,10h-imidazo[1,2-alpha] indeno [1,2-3] pyrazine-4-one derivatives preparation thereof, intermediates thereof and drugs containing same RHONE POULENC RORER SA (FR) 1999-02-03 CN disclosed