SCHEMBL9670968

SCHEMBL9670968

O=C(O)c1cn(C2CC2)c2cc(N3CC4CC3CN4)c(F)cc2c1=O

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.63
ALDH1A1 P00352 4/20 0.63
LMNA P02545 3/20 0.63
HPGD P15428 2/20 0.63
HSD17B10 Q99714 2/20 0.63
CYP1A2 P05177 1/20 0.63
TOP2A P11388 1/20 0.63
CYP2C9 P11712 1/20 0.63
TOP2B Q02880 1/20 0.63
MAPT P10636 1/20 0.57
PIK3CG P48736 7/20 0.51
PIK3CD O00329 5/20 0.50
PIK3R1 P27986 5/20 0.50
PIK3CA P42336 5/20 0.50
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL9748481 1.00 KDM4E (0.63) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9670775 0.93 KDM4E (0.64) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9866284 0.90 KDM4E (0.61) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9670973 0.87 KDM4E (0.48) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9748487 0.87 KDM4E (0.48) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9685908 0.84 ALDH1A1 (0.44) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9684708 0.84 ALDH1A1 (0.44) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9749465 0.84 KDM4E (0.61) KDM4EALDH1A1LMNAHPGDHSD17B10
Danofloxacin SCHEMBL10073753 0.83 KDM4E (0.62) KDM4EALDH1A1LMNAHPGDHSD17B10
Danofloxacin SCHEMBL29658817 0.83 KDM4E (0.62) KDM4EALDH1A1LMNAHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0274033-B1 PROCESS FOR THE PREPARATION OF QUINOLINECARBOXYLIC ACIDS BAYER AG (DE) 1992-03-11 EP disclosed
US-5091383-A SUBSTITUTED BRIDGED DIAZABICYCLOALKYL QUINOLONE CARBOXYLIC ACIDS PFIZER INC. (US) 1992-02-25 US disclosed
EP-0215650-B1 SUBSTITUTED BRIDGED-DIAZABICYCLOALKYL QUINOLONE CARBOXYLIC ACIDS PFIZER INC. (US) 1992-01-29 EP disclosed
CN-1014789-B PROCESS FOR PREPARING REPLACABLE BRIDGED HEAVY NITROGEN BICYCLOALKYL CARBOSTYRIL CARBOXYLIC ACID PFIZER (US) 1991-11-20 CN disclosed
US-4861779-A Anti-bacterial substituted bridged-diazabicycloalkyl quinolone carboxylic acids PFIZER INC. (US) 1989-08-29 US disclosed
US-4775668-A Substituted bridged-diazabicycloalkyl quinolone carboxylic acids and anti-bacterial use thereof PFIZER INC. (US) 1988-10-04 US disclosed
EP-0274033-A1 Process for the preparation of quinolinecarboxylic acids BAYER AG (DE) 1988-07-13 EP disclosed
EP-0230274-A2 Derivatives of 7-(azabicycloalkyl)-quinoloncarboxylic acid and -naphthyridoncarboxylic acid BAYER AG (DE) 1987-07-29 EP disclosed