SCHEMBL9703898

SCHEMBL9703898

CCOC(=O)c1cn2c3c(c(N4CCNCC4)c(Cl)cc3c1=O)C=CC2C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.41
HPGD P15428 4/20 0.36
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 5/20 0.36
POLB P06746 1/20 0.35
ADRB2 P07550 1/20 0.35
MEN1 O00255 2/20 0.35
MAPK10 P53779 1/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 1/20 0.35
BAZ2B Q9UIF8 1/20 0.35
BAZ2A Q9UIF9 1/20 0.35
KDM4E B2RXH2 3/20 0.35
CYP2C19 P33261 1/20 0.35
STAT3 P40763 1/20 0.35
USP2 O75604 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
PKM P14618 1/20 0.34
HSD17B10 Q99714 2/20 0.34

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
SCHEMBL9703966 0.91 HPGD (0.44) DYRK1AHPGDKMT2AALDH1A1POLB
SCHEMBL9704640 0.90 KMT2A (0.45) HPGDKMT2AALDH1A1POLBMEN1
SCHEMBL9704612 0.90 KDM4E (0.42) HPGDKMT2AALDH1A1POLBADRB2
SCHEMBL9703371 0.87 KDM4E (0.43) HPGDALDH1A1POLBLMNAKDM4E
Hydrochloric Acid SCHEMBL9703676 0.86 KDM4E (0.42) HPGDALDH1A1POLBLMNAKDM4E
SCHEMBL9703766 0.86 HPGD (0.37) HPGDKMT2AALDH1A1POLBADRB2
SCHEMBL9703318 0.84 PLAT (0.35) DYRK1AHPGDKMT2AALDH1A1POLB
SCHEMBL9704661 0.81 DYRK1A (0.39) DYRK1AHPGDKMT2AALDH1A1POLB
SCHEMBL9703387 0.80 MEN1 (0.51) HPGDKMT2AALDH1A1POLBADRB2
SCHEMBL9704563 0.79 ALDH1A1 (0.42) HPGDALDH1A1POLBLMNAKDM4E

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