SCHEMBL9230640

SCHEMBL9230640

CC(=O)O[C@H](Cc1ncc2sccn12)NC(=O)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
RECQL P46063 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL8041507 0.77 KDM4E (0.36) KDM4EALDH1A1HPGDRECQLHSD17B10
SCHEMBL8041520 0.77 KDM4E (0.30) KDM4E
SCHEMBL8041485 0.72 SSTR4 (0.33) KDM4E
SCHEMBL9229660 0.72 SMN1; SMN2 (0.37) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL8053799 0.72 SSTR4 (0.33) KDM4E
SCHEMBL8059116 0.71 ELANE (0.33) KDM4E
SCHEMBL8053507 0.70 ALOX15 (0.40) KDM4EALDH1A1HPGDRECQLHSD17B10
SCHEMBL8054483 0.70 HPGD (0.40) KDM4EALDH1A1HPGDRECQLHSD17B10
SCHEMBL8052959 0.68 MAPT (0.33) KDM4EALDH1A1HPGDRECQLHSD17B10
SCHEMBL8041362 0.68 HSD17B10 (0.37) KDM4EALDH1A1HPGDRECQLHSD17B10

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
EP-0669336-A1 NOVEL CEPHEM DERIVATIVE MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-08-30 EP disclosed