SCHEMBL9750328

SCHEMBL9750328

CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CCC4CCC(C3)N4)cc21

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.72
ALDH1A1 P00352 6/20 0.72
HPGD P15428 5/20 0.72
HSD17B10 Q99714 4/20 0.72
HTT P42858 4/20 0.72
LMNA P02545 3/20 0.72
TSHR P16473 2/20 0.72
BRD4 O60885 1/20 0.72
CYP2J2 P51589 1/20 0.72
NPSR1 Q6W5P4 1/20 0.72
DRD3 P35462 1/20 0.67
MEN1 O00255 5/20 0.62
KMT2A Q03164 5/20 0.62
NPC1 O15118 1/20 0.62
HIF1A Q16665 1/20 0.58
USP2 O75604 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
MAPT P10636 1/20 0.55
PIK3CD O00329 2/20 0.55
PIK3R1 P27986 2/20 0.55

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
SCHEMBL9749226 0.94 KDM4E (0.71) KDM4EALDH1A1HPGDHSD17B10HTT
SCHEMBL9048236 0.86 TOP1 (0.71) KDM4EALDH1A1HPGDHSD17B10HTT
Hydrochloric Acid SCHEMBL8571733 0.85 TOP1 (0.70) KDM4EALDH1A1HPGDHSD17B10HTT
SCHEMBL10621421 0.85 TOP1 (0.72) KDM4EALDH1A1HPGDHSD17B10HTT
Norfloxacin SCHEMBL27395494 0.84 ALDH1A1 (1.00) KDM4EALDH1A1HPGDHSD17B10HTT
Norfloxacin SCHEMBL2221304 0.84 ALDH1A1 (1.00) KDM4EALDH1A1HPGDHSD17B10HTT
Norfloxacin SCHEMBL3473 0.84 ALDH1A1 (1.00) KDM4EALDH1A1HPGDHSD17B10HTT
SCHEMBL9749182 0.84 DRD3 (0.69) KDM4EALDH1A1HPGDHSD17B10HTT
SCHEMBL10619341 0.84 DRD3 (0.66) KDM4EALDH1A1HPGDHSD17B10HTT
SCHEMBL5752305 0.83 KDM4E (0.76) KDM4EALDH1A1HPGDHSD17B10HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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-0215650-A2 Substituted bridged-diazabicycloalkyl quinolone carboxylic acids PFIZER INC. (US) 1987-03-25 EP disclosed