SCHEMBL3328408

SCHEMBL3328408

CC(=O)NC[C@@H]1CN(c2ccc(-c3ccc(C4=NOC(CO)C4)s3)cn2)C(=O)O1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CETP P11597 4/20 0.44
KCNH2 Q12809 2/20 0.44
MAOA P21397 4/20 0.41
MAOB P27338 2/20 0.41
F10 P00742 5/20 0.41
LMNA P02545 1/20 0.40
PTGS1 P23219 1/20 0.40
CALML3 P27482 1/20 0.40
SDHA P31040 1/20 0.40
ABCB11 O95342 1/20 0.39

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
SCHEMBL13298961 1.00 CETP (0.44) CETPKCNH2MAOAMAOBF10
SCHEMBL3327665 0.90 MAOA (0.48) MAOAMAOBF10LMNAPTGS1
SCHEMBL13298960 0.85 MAOA (0.50) MAOAMAOBF10LMNAPTGS1
SCHEMBL28752168 0.84 CETP (0.36) CETPKCNH2MAOAMAOBF10
SCHEMBL3328419 0.80 MAOA (0.60) MAOAMAOBF10LMNAPTGS1
SCHEMBL3325901 0.80 MAOA (0.42) CETPKCNH2MAOAMAOB
SCHEMBL3326555 0.80 MAOA (0.51) MAOAMAOBF10LMNAPTGS1
SCHEMBL3328545 0.80 MAOA (0.51) MAOAMAOBF10LMNAPTGS1
SCHEMBL3328540 0.80 MAOA (0.51) MAOAMAOBF10LMNAPTGS1
SCHEMBL3326613 0.80 MAOA (0.51) MAOAMAOBF10LMNAPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137243-A1 Oxazolidinone And/Or Isoxazoline As Antibacterial Agents ASTRAZENECA AB (SE) 2010-06-03 US disclosed
US-7396847-B2 Oxazolidinone and/or isoxazoline as antibacterial agents ASTRAZENECA AB (SE) 2008-07-08 US disclosed
US-20050107435-A1 Oxazolidinone and/or isoxazoline as antibacterial agents ASTRAZENECA AB (SE) 2005-05-19 US 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 (2 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-20100137243-A1 Oxazolidinone And/Or Isoxazoline As Antibacterial Agents CYP8B1, HRH2, CYP2W1 CETP 4012/4885KCNH2 1898/4885MAOA 482/4885
US-20050107435-A1 Oxazolidinone and/or isoxazoline as antibacterial agents CYP8B1, CYP2W1, HRH2 CETP 4206/4885KCNH2 2193/4885MAOA 800/4885

“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.