SCHEMBL9749429

SCHEMBL9749429

CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CC4CCC(C3)N4C)c(F)c21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.67
ALDH1A1 P00352 7/20 0.67
HPGD P15428 6/20 0.67
HSD17B10 Q99714 5/20 0.67
PMP22 Q01453 1/20 0.66
KCNH2 Q12809 6/20 0.52
DRD3 P35462 1/20 0.49
POLB P06746 2/20 0.47
OPRM1 P35372 2/20 0.47
CHRM2 P08172 1/20 0.47
CHRM1 P11229 1/20 0.47
OPRD1 P41143 1/20 0.47
PIM1 P11309 1/20 0.47
LMNA P02545 2/20 0.46
MAPT P10636 1/20 0.46
BRD4 O60885 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
CYP2J2 P51589 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL9749475 0.92 KDM4E (0.71) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL10621416 0.87 KDM4E (0.68) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9670575 0.86 KCNH2 (0.60) KDM4EALDH1A1HPGDHSD17B10KCNH2
SCHEMBL9524138 0.85 KDM4E (0.72) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL10407666 0.85 KDM4E (0.66) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9838764 0.84 KDM4E (0.59) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL10823302 0.84 KDM4E (0.75) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL10621384 0.84 KDM4E (0.69) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9749468 0.84 KCNH2 (0.51) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL11037930 0.84 KDM4E (0.67) KDM4EALDH1A1HPGDHSD17B10PMP22

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 6 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
EP-0159174-B1 SUBSTITUTED NAPHTHYRIDINE-, QUINOLINE- AND BENZOXAZINE- CARBOXYLIC ACIDS AS ANTIBACTERIAL AGENTS AND PROCESSES FOR THEIR PRODUCTION WARNER-LAMBERT COMPANY (US) 1991-10-23 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