SCHEMBL28600337

SCHEMBL28600337

CCn1cc(C(=O)/C=C/c2ccc(C)cc2)c(=O)c2cc(F)c(N3CCN(C(C)=O)C(C)C3)c(F)c21

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 10/20 0.51
▸ ALDH1A1 P00352 4/20 0.51
▸ HPGD P15428 4/20 0.51
▸ HSD17B10 Q99714 2/20 0.51
▸ PMP22 Q01453 1/20 0.51
▸ LMNA P02545 2/20 0.40
▸ POLB P06746 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ ATM Q13315 1/20 0.37
▸ TOP1 P11387 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ DRD3 P35462 1/20 0.35

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
SCHEMBL28600340 1.00 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28579439 0.94 KDM4E (0.52) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28579437 0.94 KDM4E (0.52) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28579491 0.94 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28579488 0.94 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28584211 0.93 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28577475 0.93 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28577476 0.93 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28584205 0.93 KDM4E (0.54) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL28584206 0.93 KDM4E (0.54) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112824396-B Acrylic ketone derivative of N-acetyl lomefloxacin and preparation method and application thereof 河南大学 2023-08-11 — — CN disclosed
CN-112824396-A N-acetyl lomefloxacin allyl ketone derivative and preparation method and application thereof 河南大学 2021-05-21 — — CN disclosed
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