SCHEMBL9704598

SCHEMBL9704598

CCOC(=O)c1cn2c3c(c(F)c(F)cc3c1=O)C(=O)CC2C

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 2/20 0.50
ADRB2 P07550 1/20 0.49
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 6/20 0.44
HPGD P15428 3/20 0.44
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 2/20 0.44
HTT P42858 1/20 0.41
TOP2A P11388 5/20 0.41
TOP2B Q02880 5/20 0.41
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39

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
SCHEMBL9703781 0.90 ADRB2 (0.46) STAT3ADRB2KMT2AKDM4EHPGD
SCHEMBL9703747 0.85 KDM4E (0.43) STAT3ADRB2KMT2AKDM4EHPGD
SCHEMBL9703871 0.85 KDM4E (0.53) ADRB2KMT2AKDM4EHPGDALDH1A1
SCHEMBL9703249 0.84 KDM4E (0.45) STAT3ADRB2KMT2AKDM4EHPGD
SCHEMBL9705523 0.84 ADRB2 (0.42) STAT3ADRB2KMT2AKDM4EHPGD
SCHEMBL9704650 0.84 KDM4E (0.43) STAT3ADRB2KDM4EHPGDALDH1A1
SCHEMBL9704619 0.83 BAZ2B (0.40) STAT3ADRB2KMT2AKDM4EHPGD
SCHEMBL9703878 0.83 KDM4E (0.43) STAT3ADRB2KDM4EHPGDALDH1A1
SCHEMBL11720415 0.82 KDM4E (0.47) STAT3ADRB2KMT2AKDM4EHPGD
SCHEMBL9703631 0.82 KDM4E (0.54) STAT3ADRB2KDM4EHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0203795-B1 Benzo [i,j] quinolizine-2-carboxylic acid derivatives, the salts and their hydrates, pharmaceutical compositions thereof, and process for preparing the same TOKYO TANABE COMPANY LIMITED (JP) 1992-07-29 EP disclosed
US-4720495-A Benzo[ij]quinolizine-2-carboxylic acids useful for treating bacterial infection TOKYO TANABE CO. LIMITED (JP) 1988-01-19 US disclosed
EP-0203795-A2 Benzo [i,j] quinolizine-2-carboxylic acid derivatives, the salts and their hydrates, pharmaceutical compositions thereof, and process for preparing the same TOKYO TANABE COMPANY LIMITED (JP) 1986-12-03 EP disclosed