SCHEMBL9569232

SCHEMBL9569232

CC1(C)CN(c2c(F)cc3c(=O)c(C(=O)O)c[nH]c3c2F)CC1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.39
▸ ALDH1A1 P00352 5/20 0.38
▸ HPGD P15428 5/20 0.38
▸ HSD17B10 Q99714 5/20 0.38
▸ PMP22 Q01453 1/20 0.38
▸ CSNK2A2 P19784 3/20 0.37
▸ CSNK2B P67870 3/20 0.37
▸ CSNK2A1 P68400 3/20 0.37
▸ LMNA P02545 3/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ ADRA2B P18089 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ ATP6V1B2 P21281 1/20 0.34
▸ TBXA2R P21731 1/20 0.34
▸ EDNRA P25101 1/20 0.34
▸ TARBP2 Q15633 1/20 0.34
▸ TET2 Q6N021 1/20 0.33
▸ TET1 Q8NFU7 1/20 0.33

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
SCHEMBL9569217 0.88 KDM4E (0.37) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9262366 0.80 KDM4E (0.46) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9569224 0.76 KDM4E (0.39) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9569215 0.75 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9626398 0.74 KDM4E (0.48) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL1878010 0.73 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10CSNK2A2
SCHEMBL9538007 0.73 LMNA (0.36) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL10755601 0.73 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL11258062 0.72 CSNK2A1 (0.52) KDM4EALDH1A1HPGDHSD17B10CSNK2A2
SCHEMBL9569209 0.72 HPGD (0.46) KDM4EALDH1A1HPGDHSD17B10CSNK2A2

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-0541086-A1 Antibacterial 6-fluoro-quinolones having an oxime group on the substituent in position 7 Kaken Pharmaceutical Co., Ltd. (JP) 1993-05-12 — — EP disclosed
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