SCHEMBL9705480

SCHEMBL9705480

CC1CN(c2c(F)cc3c(=O)c(C(=O)O)cn4c3c2C=CC4C)C(C)CN1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.50
ALDH1A1 P00352 7/20 0.50
HPGD P15428 7/20 0.50
HSD17B10 Q99714 6/20 0.50
POLB P06746 2/20 0.50
KCNH2 Q12809 2/20 0.50
PRKD3 O94806 1/20 0.50
ALOX15 P16050 1/20 0.50
OPRM1 P35372 1/20 0.50
CLK2 P49760 1/20 0.50
CLK4 Q9HAZ1 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PMP22 Q01453 1/20 0.47
LMNA P02545 2/20 0.44
ALB P02768 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
AADAT Q8N5Z0 2/20 0.43
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43

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
SCHEMBL9703268 0.88 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL9703751 0.84 ALDH1A1 (0.64) KDM4EALDH1A1HPGDHSD17B10POLB
Hydrochloric Acid SCHEMBL9705513 0.84 ALDH1A1 (0.65) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL9704629 0.83 KDM4E (0.53) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL9634956 0.82 ALDH1A1 (0.64) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL9703120 0.81 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL10995554 0.80 LMNA (0.47) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL9703761 0.79 KDM4E (0.52) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL6832081 0.79 KDM4E (0.75) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL9703783 0.79 KDM4E (0.52) KDM4EALDH1A1HPGDHSD17B10POLB

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