SCHEMBL9265454

SCHEMBL9265454

C[C@H]1C[C@H](N)CN1c1cc2c(cc1F)c(=O)c(C(=O)O)cn2C1COC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ LMNA P02545 3/20 0.49
▸ HPGD P15428 2/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ MAPT P10636 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ TOP2A P11388 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ TOP2B Q02880 1/20 0.49
▸ KMT2A Q03164 1/20 0.42
▸ PIK3CG P48736 5/20 0.42
▸ PIK3CD O00329 3/20 0.42
▸ PIK3R1 P27986 3/20 0.42
▸ PIK3CA P42336 3/20 0.42
▸ HTT P42858 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ AADAT Q8N5Z0 2/20 0.41
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40

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
SCHEMBL9045098 0.92 ALDH1A1 (0.60) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9043221 0.82 DRD3 (0.60) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9046654 0.80 LMNA (0.62) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL10514084 0.80 KMT2A (0.54) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9043188 0.80 KMT2A (0.54) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL8131494 0.80 KDM4E (0.56) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL10913936 0.79 KDM4E (0.63) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9267263 0.78 ALDH1A1 (0.67) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9142804 0.78 ALDH1A1 (0.62) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL9142836 0.78 ALDH1A1 (0.62) KDM4EALDH1A1LMNAHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5407932-A Bactericides WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1995-04-18 — — US disclosed
EP-0393400-B1 Novel quinolone derivatives, preparation processes thereof, and antibacterial agents containing the same WAKUNAGA SEIYAKU KK (JP) 1994-12-21 — — EP disclosed
US-5245037-A Synthetic bactericides WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1993-09-14 — — US disclosed
EP-0393400-A1 Novel quinolone derivatives, preparation processes thereof, and antibacterial agents containing the same WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1990-10-24 — — EP disclosed
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