SCHEMBL3289377

SCHEMBL3289377

CCOC(=O)c1cn(N(C)C)c2ncc(CCCNC(=O)C(C)(C)C)cc2c1=O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.36
PDE4B Q07343 2/20 0.36
PDE5A O76074 1/20 0.36
ADRB2 P07550 1/20 0.35
KDM4E B2RXH2 3/20 0.34
ADORA1 P30542 1/20 0.34
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
RAB9A P51151 2/20 0.33
ATM Q13315 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 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
SCHEMBL3291509 0.88 POLB (0.42) POLBKDM4ERAB9ANPC1
SCHEMBL3974878 0.77 TSHR (0.41) POLBKDM4EKMT2AMEN1RAB9A
SCHEMBL3289956 0.76 LMNA (0.50) CYP1A2POLBPDE4BKDM4EKMT2A
SCHEMBL20521059 0.74 KDM4E (0.40) CYP1A2PDE4BKDM4EKMT2AMEN1
SCHEMBL29705131 0.74 KDM4E (0.40) CYP1A2PDE4BKDM4EKMT2AMEN1
SCHEMBL1132860 0.72 LMNA (0.46) POLBADRB2KMT2AMEN1RAB9A
SCHEMBL3291390 0.69 LMNA (0.39) POLBADRB2KDM4EKMT2AMEN1
SCHEMBL3296373 0.68 LMNA (0.39) ADRB2KDM4EKMT2AMEN1MAPT
SCHEMBL23646765 0.68 LMNA (0.44) CYP1A2POLBPDE4BKDM4EKMT2A
SCHEMBL3289057 0.68 ADRB2 (0.43) POLBADRB2KDM4EKMT2AMEN1

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-7718621-B2 Macrolones—amino substituted quinolones GLAXO GROUP LTD. (GB) 2010-05-18 US disclosed
US-20080090773-A1 Macrolones - Amino Substituted Quinolones GLAXO GROUP LIMITED (GB) 2008-04-17 US disclosed
EP-1824870-A1 MACROLONES - AMINO SUBSTITUTED QUINOLONES GLAXO GROUP LIMITED (GB) 2007-08-29 EP disclosed
WO-2006050942-A1 MACROLONES - AMINO SUBSTITUTED QUINOLONES GLAXO GROUP LIMITED (GB) 2006-05-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080090773-A1 Macrolones - Amino Substituted Quinolones MRPL21, Q6ZSR9, QARS1 CYP1A2 273/4885POLB 1116/4885PDE4B 2079/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.