SCHEMBL8319696

SCHEMBL8319696

CCOC(=O)OC1=CCN(Cc2ccccc2)C1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
LMNA P02545 3/20 0.43
SIGMAR1 Q99720 2/20 0.43
ALDH1A1 P00352 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
ADORA1 P30542 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL3222039 0.78 LMNA (0.48) MEN1KMT2ACYP3A4CYP2D6CYP2C9
SCHEMBL2951668 0.77 ALDH1A1 (0.40) KMT2ACYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL27920146 0.75 SIGMAR1 (0.51) MEN1KMT2ALMNASIGMAR1ALDH1A1
SCHEMBL5778817 0.72 MEN1 (0.56) MEN1KMT2ACYP3A4CYP2D6CYP2C9
SCHEMBL431539 0.71 CYP3A4 (0.56) MEN1KMT2ACYP3A4CYP2D6CYP2C9
SCHEMBL6621542 0.70 SIGMAR1 (0.52) LMNASIGMAR1ALDH1A1POLBGAA
SCHEMBL1344511 0.70 CYP2D6 (0.46) KMT2ACYP3A4CYP2D6LMNASIGMAR1
SCHEMBL7534318 0.70 MEN1 (0.47) MEN1KMT2ACYP2D6LMNAALDH1A1
SCHEMBL11136854 0.70 SIGMAR1 (0.44) MEN1KMT2ACYP3A4CYP2D6LMNA
SCHEMBL6953942 0.69 BCHE (0.61) SIGMAR1ALDH1A1SMN1; SMN2OPRM1

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
EP-0705828-B1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1999-12-01 EP disclosed
EP-0721948-B1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1997-12-03 EP disclosed
EP-0721948-A1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1996-07-17 EP disclosed
EP-0705828-A1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1996-04-10 EP disclosed