SCHEMBL8180905

SCHEMBL8180905

O=C(O)N1CC[C@H](NC(=O)C(F)(F)F)C1=O

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 2/20 0.35
ELANE P08246 3/20 0.35
HTT P42858 2/20 0.34
NCOA1 Q15788 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
RAB9A P51151 1/20 0.33
HPSE Q9Y251 1/20 0.32
FPR1 P21462 2/20 0.31
FPR2 P25090 2/20 0.31
PGR P06401 1/20 0.30
RIPK1 Q13546 1/20 0.30

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
SCHEMBL7413298 0.76 ELANE (0.46) ELANEHTTGAARAB9A
SCHEMBL5648102 0.69 KDM4E (0.34) KDM4EALDH1A1ELANEHTTNCOA1
SCHEMBL28171551 0.67 PER2 (0.32) ALDH1A1
SCHEMBL7767003 0.67 KDM4E (0.40) KDM4EALDH1A1ELANEHTTNCOA1
SCHEMBL9985612 0.66 ALDH1A1 (0.47) ALDH1A1LMNA
SCHEMBL13485270 0.66 CYP1A2 (0.43) KDM4EALDH1A1HTTNCOA1NCOA3
SCHEMBL5640189 0.65 GAA (0.44) GAA
SCHEMBL5638007 0.65 GAA (0.44) GAA
SCHEMBL6618485 0.65 CCR2 (0.55) KDM4EALDH1A1HTTNCOA1NCOA3
SCHEMBL6618482 0.65 CCR2 (0.55) KDM4EALDH1A1HTTNCOA1NCOA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000018770-A1 PYRROLOPYRROLONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXO GROUP LIMITED (GB) 2000-04-06 WO disclosed