SCHEMBL9750281

SCHEMBL9750281

COn1cc(C(=O)O)c(=O)c2cc(F)c(N3CCN4CCCC3C4)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
KDM4E B2RXH2 6/20 0.46
HSD17B10 Q99714 7/20 0.46
LMNA P02545 5/20 0.46
HPGD P15428 5/20 0.46
MAPT P10636 1/20 0.46
CYP1A2 P05177 1/20 0.46
TOP2A P11388 1/20 0.46
CYP2C9 P11712 1/20 0.46
TOP2B Q02880 1/20 0.46
PIK3CG P48736 2/20 0.42
PIK3CD O00329 1/20 0.42
PIK3R1 P27986 1/20 0.42
PIK3CA P42336 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
DRD3 P35462 1/20 0.42
BRD4 O60885 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL10687150 0.88 ALDH1A1 (0.49) ALDH1A1KDM4EHSD17B10LMNAHPGD
SCHEMBL9749120 0.85 ALDH1A1 (0.46) ALDH1A1KDM4EHSD17B10LMNAHPGD
SCHEMBL9748759 0.85 DRD3 (0.61) ALDH1A1KDM4EHSD17B10LMNAHPGD
SCHEMBL10558662 0.84 ALDH1A1 (0.46) ALDH1A1KDM4EHSD17B10LMNAHPGD
SCHEMBL9749228 0.83 ALDH1A1 (0.48) ALDH1A1KDM4EHSD17B10LMNAHPGD
SCHEMBL9749607 0.82 LMNA (0.62) ALDH1A1KDM4EHSD17B10LMNAHPGD
SCHEMBL9748119 0.80 KDM4E (0.44) ALDH1A1KDM4EHSD17B10LMNAHPGD
SCHEMBL9750291 0.79 ALDH1A1 (0.48) ALDH1A1KDM4EHSD17B10LMNAHPGD
SCHEMBL9670956 0.79 DRD3 (0.63) ALDH1A1KDM4EHSD17B10LMNAHPGD
SCHEMBL9747974 0.79 ALDH1A1 (0.54) ALDH1A1KDM4EHSD17B10LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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