SCHEMBL10487355

SCHEMBL10487355

CC1C(=O)OC(=O)[C@H]1NC(=O)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
ELANE P08246 6/20 0.33
ASGR1 P07306 1/20 0.32
CA2 P00918 1/20 0.31
HTT P42858 1/20 0.31
NCOA1 Q15788 1/20 0.31
NCOA3 Q9Y6Q9 1/20 0.31
TLR9 Q9NR96 1/20 0.30
RAB9A P51151 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
SCHEMBL10487291 0.77 KDM4E (0.35) KDM4EALDH1A1LMNAGAAELANE
SCHEMBL10487295 0.71 KDM4E (0.38) KDM4EALDH1A1LMNAGAAASGR1
SCHEMBL3825323 0.64 KDM4E (0.43) KDM4EALDH1A1LMNAGAAASGR1
SCHEMBL5413587 0.64 KDM4E (0.43) KDM4EALDH1A1LMNAGAAASGR1
SCHEMBL5344420 0.64 KDM4E (0.43) KDM4EALDH1A1LMNAGAAASGR1
SCHEMBL4756184 0.63
SCHEMBL11892837 0.63
SCHEMBL879063 0.63
SCHEMBL106898 0.63
SCHEMBL22534064 0.62 KDM4E (0.39) KDM4EALDH1A1LMNAGAAASGR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4874878-A CHEMICAL INTERMEDIATES FOR ANTIDEPRESSANTS ADIR ET CIE (FR) 1989-10-17 US disclosed
US-4851429-A ANTIDEPRESSANT, TRANQUILIZERS ADIR ET CIE (FR) 1989-07-25 US disclosed