SCHEMBL9016703

SCHEMBL9016703

CCOC(=O)CC(=O)c1cc(F)c(N2CCCC2)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.41
LMNA P02545 3/20 0.41
MAPK1 P28482 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
ALDH1A1 P00352 7/20 0.41
HTT P42858 2/20 0.41
GPR174 Q9BXC1 1/20 0.39
TSHR P16473 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
HPGD P15428 3/20 0.38
USP2 O75604 1/20 0.38
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL3606905 0.90 MEN1 (0.47) MAPTLMNAMAPK1CASP1CASP7
SCHEMBL6798131 0.84 ALDH1A1 (0.50) MAPTLMNACASP1ALDH1A1HTT
SCHEMBL30958584 0.80 ALDH1A1 (0.44) MAPTLMNAMAPK1CASP1CASP7
SCHEMBL1185918 0.80 ALDH1A1 (0.44) MAPTLMNAMAPK1CASP1CASP7
SCHEMBL10511114 0.78 CHEK1 (0.39) MAPTLMNAMAPK1CASP1CASP7
SCHEMBL8155555 0.77 KDM4E (0.42) MAPTLMNAMAPK1CASP1CASP7
SCHEMBL10512661 0.76 CHEK1 (0.38) MAPTLMNAMAPK1CASP1CASP7
SCHEMBL10516112 0.76 ALDH1A1 (0.41) MAPTLMNAMAPK1CASP1CASP7
Acetic Acid SCHEMBL8870017 0.76 ALDH1A1 (0.41) MAPTLMNAMAPK1CASP1CASP7
SCHEMBL30736446 0.76 MEN1 (0.41) MAPTLMNAMAPK1CASP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0481441-B1 Novel cephem compounds, their preparation processes and antibacterial agents KYORIN SEIYAKU KK (JP) 1996-12-11 EP disclosed
US-5244892-A Pseudomonas KYORIN PHARMACEUTICAL CO., LTD. (JP) 1993-09-14 US disclosed
EP-0481441-A2 Novel cephem compounds, their preparation processes and antibacterial agents KYORIN PHARMACEUTICAL CO., LTD. (JP) 1992-04-22 EP disclosed