SCHEMBL9703759

SCHEMBL9703759

COC(=O)c1cn2c3c(c(Cl)c(Br)cc3c1=O)C(=O)CC2C

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP1A2 P05177 1/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
ALDH1A1 P00352 2/20 0.34
USP2 O75604 2/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
TOP2A P11388 4/20 0.32
TOP2B Q02880 4/20 0.32
LMNA P02545 4/20 0.32
HPGD P15428 1/20 0.32
RECQL P46063 1/20 0.32
CNR2 P34972 6/20 0.32
CNR1 P21554 3/20 0.32
MAPK1 P28482 1/20 0.31

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
SCHEMBL9703892 0.87 TOP2A (0.40) KDM4ESMN1; SMN2CYP1A2KMT2AALDH1A1
SCHEMBL9704619 0.78 BAZ2B (0.40) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL9703818 0.77 KDM4E (0.48) KDM4ESMN1; SMN2CYP1A2KMT2AALDH1A1
SCHEMBL9703781 0.76 ADRB2 (0.46) KDM4ESMN1; SMN2CYP1A2KMT2AALDH1A1
SCHEMBL9703785 0.75 KDM4E (0.52) KDM4ESMN1; SMN2CYP1A2KMT2AALDH1A1
SCHEMBL10401667 0.74 KDM4E (0.55) KDM4EALDH1A1LMNAHPGDMAPK1
SCHEMBL9703924 0.71 KDM4E (0.45) KDM4EALDH1A1MAPTLMNAHPGD
SCHEMBL9703601 0.70 KDM4E (0.55) KDM4ESMN1; SMN2CYP1A2ALDH1A1TOP2A
SCHEMBL9704598 0.69 STAT3 (0.50) KDM4ESMN1; SMN2CYP1A2KMT2AALDH1A1
SCHEMBL9705531 0.68 HPGD (0.38) KDM4EKMT2AMEN1ALDH1A1MAPT

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 2 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
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