SCHEMBL6375989

SCHEMBL6375989

CCOC(=O)C1Nc2cc(-n3ccc(C=O)c3)c(C)cc2NC1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.38
TP53 P04637 3/20 0.38
POLB P06746 2/20 0.38
KDM4E B2RXH2 5/20 0.36
HSD17B10 Q99714 4/20 0.36
ALDH1A1 P00352 2/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
ALOX15 P16050 1/20 0.36
GAA P10253 6/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HPGD P15428 2/20 0.34
MAPK1 P28482 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GRIA1 P42261 1/20 0.33
GRIA2 P42262 1/20 0.33

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
SCHEMBL6376380 0.90 HSD17B10 (0.34) MAPTTP53POLBKDM4EHSD17B10
SCHEMBL6605330 0.88 GRIA1 (0.47) MAPTTP53POLBKDM4EMEN1
Hydrochloric Acid SCHEMBL6378430 0.74 TP53 (0.34) TP53KDM4EMEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL6603295 0.72 GRIA1 (0.48) GRIA1GRIA2GRIA3GRIA4
Hydrochloric Acid SCHEMBL6381595 0.72 MAPT (0.41) MAPTTP53POLBKDM4EHSD17B10
SCHEMBL9705704 0.71 KDM4E (0.42) MAPTTP53POLBKDM4EHSD17B10
SCHEMBL11260228 0.71 KDM4E (0.42) MAPTTP53POLBKDM4EHSD17B10
SCHEMBL6378073 0.68 MAPT (0.36) MAPTTP53POLBKDM4ELMNA
SCHEMBL9704329 0.68 MAPK1 (0.44) MAPTTP53KDM4EALDH1A1LMNA
SCHEMBL2776008 0.68 KDM4E (0.42) MAPTTP53POLBKDM4EHSD17B10

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-6632813-B1 6-subtituted-7-heteroquinoxalinecarboxylic acid derivatives and addition salts thereof and processes for the preparation of both KYORIN PHARMACEUTICAL CO., LTD. (JP) 2003-10-14 US claimed
EP-1156047-B1 6-SUBSTITUTED-7- HETEROQUINOXALINE CARBOXYLIC ACID DERIVATIVES AND ADDITION SALTS THEREOF AND PROCESSES FOR THE PREPARATION OF BOTH KYORIN SEIYAKU KK (JP) 2005-08-31 EP disclosed
US-6632813-B1 6-subtituted-7-heteroquinoxalinecarboxylic acid derivatives and addition salts thereof and processes for the preparation of both KYORIN PHARMACEUTICAL CO., LTD. (JP) 2003-10-14 US disclosed
EP-1156047-A1 6-SUBSTITUTED-7- HETEROQUINOXALINE CARBOXYLIC ACID DERIVATIVES AND ADDITION SALTS THEREOF AND PROCESSES FOR THE PREPARATION OF BOTH KYORIN PHARMACEUTICAL CO., LTD. (JP) 2001-11-21 EP disclosed