SCHEMBL28415129

SCHEMBL28415129

CC(=O)N1CCN(c2c(F)cc3c(=O)c(C(=O)/C=C/c4ccccc4)cn(CCF)c3c2F)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 10/20 0.60
▸ ALDH1A1 P00352 5/20 0.41
▸ HPGD P15428 4/20 0.41
▸ HSD17B10 Q99714 4/20 0.41
▸ PMP22 Q01453 1/20 0.41
▸ MAPT P10636 2/20 0.39
▸ GAA P10253 1/20 0.38
▸ HTT P42858 2/20 0.38
▸ TOP2A P11388 2/20 0.38
▸ TOP2B Q02880 2/20 0.38
▸ TOP1 P11387 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ HDAC4 P56524 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37

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
SCHEMBL28415130 1.00 KDM4E (0.60) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28412322 0.93 KDM4E (0.58) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28412320 0.93 KDM4E (0.58) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28417382 0.92 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28417380 0.92 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28418046 0.92 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28418044 0.92 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28416321 0.92 KDM4E (0.71) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28416319 0.92 KDM4E (0.71) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28409442 0.92 KDM4E (0.56) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111303025-A N-acetyl fleroxacin propenone derivative and preparation method and application thereof 郑州工业应用技术学院 2020-06-19 — — CN disclosed
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