SCHEMBL9703806

SCHEMBL9703806

CCOC(=O)c1cn2c3c(c(N4CCN(C)CC4)c(Cl)cc3c1=O)C(=O)CC2C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
MAPK10 P53779 1/20 0.43
ALDH1A1 P00352 7/20 0.43
KDM4E B2RXH2 5/20 0.43
HPGD P15428 5/20 0.43
HSD17B10 Q99714 2/20 0.43
ALB P02768 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
USP2 O75604 1/20 0.42
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
TUBB4A P04350 4/20 0.42
TUBB P07437 4/20 0.42
TUBA3C P0DPH7 4/20 0.42
TUBA1B P68363 4/20 0.42
TUBA4A P68366 4/20 0.42
TUBB4B P68371 4/20 0.42
TUBB3 Q13509 4/20 0.42

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
SCHEMBL9704661 0.90 DYRK1A (0.39) KMT2AMEN1MAPK10ALDH1A1KDM4E
SCHEMBL9703871 0.89 KDM4E (0.53) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL9705531 0.89 HPGD (0.38) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL9703884 0.87 KDM4E (0.55) ALDH1A1KDM4EHPGDHSD17B10ALB
SCHEMBL9703286 0.86 HPGD (0.44) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL9704619 0.85 BAZ2B (0.40) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL9703249 0.81 KDM4E (0.45) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL9703580 0.81 KDM4E (0.48) ALDH1A1KDM4EHPGDHSD17B10ALB
SCHEMBL9704640 0.80 KMT2A (0.45) KMT2AMEN1MAPK10ALDH1A1KDM4E
SCHEMBL9703878 0.80 KDM4E (0.43) ALDH1A1KDM4EHPGDHSD17B10ALB

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