SCHEMBL28706094

SCHEMBL28706094

CC(=O)N1CCN(c2cc3c(cc2F)c(=O)c(CC=O)cn3C2CC2)CC1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.69
▸ ALDH1A1 P00352 4/20 0.69
▸ LMNA P02545 3/20 0.55
▸ HSD17B10 Q99714 3/20 0.55
▸ HPGD P15428 2/20 0.55
▸ MAPT P10636 1/20 0.55
▸ CYP1A2 P05177 1/20 0.51
▸ TOP2A P11388 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ TOP2B Q02880 1/20 0.51
▸ PIK3CG P48736 7/20 0.49
▸ PIK3CD O00329 5/20 0.49
▸ PIK3R1 P27986 5/20 0.49
▸ PIK3CA P42336 5/20 0.49
▸ HTT P42858 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL28568727 0.86 KDM4E (0.52) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL28891547 0.86 KDM4E (0.68) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL28559532 0.84 HSD17B10 (0.58) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL28564270 0.84 KDM4E (0.65) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL10809240 0.82 KDM4E (1.00) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL29350842 0.82 KDM4E (1.00) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL10809245 0.80 KDM4E (0.77) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL7101103 0.80 KDM4E (0.80) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL825059 0.79 KDM4E (0.92) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL28933214 0.76 KDM4E (0.73) KDM4EALDH1A1LMNAHSD17B10HPGD

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-111646937-B Propenone derivative of N-acetyl ciprofloxacin and preparation method and application thereof 河南大学 2022-01-21 — — CN disclosed
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