SCHEMBL3326548

SCHEMBL3326548

Cc1cn(C[C@H]2CN(c3cccc(F)c3)C(=O)O2)nn1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 12/20 0.65
GRM2 Q14416 3/20 0.56
MAOB P27338 2/20 0.48
FADS1 O60427 1/20 0.48
KCNH2 Q12809 2/20 0.47
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL5931081 1.00 MAOA (0.65) MAOAGRM2MAOBFADS1KCNH2
SCHEMBL13298923 0.85 MAOA (0.82) MAOAKCNH2CYP3A4CYP2D6
SCHEMBL3326714 0.83 MAOA (0.70) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL2849302 0.83 MAOA (0.70) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL15630337 0.83 GRM2 (0.49) MAOAGRM2MAOBFADS1KCNH2
SCHEMBL16934432 0.83 GRM2 (0.49) MAOAGRM2MAOBFADS1KCNH2
SCHEMBL3325391 0.82 MAOA (0.69) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL14410639 0.82 MAOA (0.60) MAOAGRM2MAOBKCNH2
SCHEMBL3367952 0.82 MAOA (0.66) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL4017518 0.82 MAOA (0.68) MAOAMAOBKCNH2CYP3A4CYP2D6

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 19 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-20100137243-A1 Oxazolidinone And/Or Isoxazoline As Antibacterial Agents ASTRAZENECA AB (SE) 2010-06-03 US disclosed
US-20100137243-A1 Oxazolidinone And/Or Isoxazoline As Antibacterial Agents ASTRAZENECA AB (SE) 2010-06-03 US disclosed
US-7473699-B2 3-cyclyl-5-(nitrogen-containing 5-membered ring)methyl-oxazolidinone derivatives and their use as antibacterial agents ASTRAZENECA AB (SE) 2009-01-06 US disclosed
US-7473699-B2 3-cyclyl-5-(nitrogen-containing 5-membered ring)methyl-oxazolidinone derivatives and their use as antibacterial agents ASTRAZENECA AB (SE) 2009-01-06 US disclosed
US-7396847-B2 Oxazolidinone and/or isoxazoline as antibacterial agents ASTRAZENECA AB (SE) 2008-07-08 US disclosed
US-7396847-B2 Oxazolidinone and/or isoxazoline as antibacterial agents ASTRAZENECA AB (SE) 2008-07-08 US disclosed
US-7157482-B2 Antibacterial 1,3-oxazolidin-2-one derivatives ASTRAZENECA AB (SE) 2007-01-02 US disclosed
US-7157482-B2 Antibacterial 1,3-oxazolidin-2-one derivatives ASTRAZENECA AB (SE) 2007-01-02 US disclosed
US-7157482-B2 Antibacterial 1,3-oxazolidin-2-one derivatives ASTRAZENECA AB (SE) 2007-01-02 US disclosed
US-20060116400-A1 Oxazolidinone and/or isoxazoline derivatives as antibacterial agents ASTRAZENECA AB (SE) 2006-06-01 US disclosed
US-20060084810-A1 Antibacterial 1,3-oxazolidin-2-one derivatives ASTRAZENECA AB (SE) 2006-04-20 US disclosed
EP-1427711-B1 OXAZOLIDINONE AND/OR ISOXAZOLINE DERIVATIVES AS ANTIBACTERIAL AGENTS ASTRAZENECA AB (SE) 2005-07-13 EP disclosed
US-20050119292-A1 3-Cyclyl-5-(nitrogen-containing 5-membered ring)methyl-oxazolidinone derivatives and their use as antibacterial agents ASTRAZENECA AB (SE) 2005-06-02 US disclosed
US-20050107435-A1 Oxazolidinone and/or isoxazoline as antibacterial agents ASTRAZENECA AB (SE) 2005-05-19 US disclosed
EP-1497286-A1 3-CYCLYL-5-(NITROGEN-CONTAINING 5-MEMBERED RING) METHYL-OXAZOLIDINONE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS Astrazeneca AB (SE) 2005-01-19 EP disclosed
EP-1427711-A1 OXAZOLIDINONE AND/OR ISOXAZOLINE DERIVATIVES AS ANTIBACTERIAL AGENTS AstraZeneca AB (SE) 2004-06-16 EP disclosed
WO-2003072575-A1 3-CYCLYL-5-(NITROGEN-CONTAINING 5-MEMBERED RING) METHYL-OXAZOLIDINONE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS ASTRAZENECA AB (SE) 2003-09-04 WO disclosed
WO-2003022824-A1 OXAZOLIDINONE AND/OR ISOXAZOLINE AS ANTIBACTERIAL AGENTS ASTRAZENECA AB (SE) 2003-03-20 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 (5 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 MAOA 482/4885GRM2 2199/4885MAOB 192/4885
US-20060084810-A1 Antibacterial 1,3-oxazolidin-2-one derivatives HRH1, HDHD5, NGLY1 MAOA 717/4885GRM2 4372/4885MAOB 898/4885
US-20050107435-A1 Oxazolidinone and/or isoxazoline as antibacterial agents CYP8B1, CYP2W1, HRH2 MAOA 800/4885GRM2 2354/4885MAOB 328/4885
US-20060116400-A1 Oxazolidinone and/or isoxazoline derivatives as antibacterial agents NR0B2, NR0B1, HRH2 MAOA 293/4885GRM2 856/4885MAOB 168/4885
US-20050119292-A1 3-Cyclyl-5-(nitrogen-containing 5-membered ring)methyl-oxazolidinone derivatives and their use as antibacterial agents H1-0, NGLY1, H1-5 MAOA 1576/4885GRM2 4001/4885MAOB 992/4885

“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.