SCHEMBL13054898

SCHEMBL13054898

O=C1O[C@@H](CN=C=S)CN1c1ccc(-n2cnc(Cn3cccn3)c2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 9/20 0.41
MAOB P27338 8/20 0.41
KCNH2 Q12809 3/20 0.39
CALML3 P27482 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2D6 P10635 1/20 0.37
LMNA P02545 1/20 0.36
PTGS1 P23219 1/20 0.36
SDHA P31040 1/20 0.36

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
SCHEMBL3752375 1.00 MAOA (0.41) MAOAMAOBKCNH2CALML3CYP3A4
SCHEMBL14024107 0.88 MAOA (0.41) MAOAMAOBKCNH2CALML3CYP3A4
SCHEMBL3758147 0.88 MAOA (0.44) MAOAMAOBKCNH2CALML3CYP3A4
SCHEMBL13054641 0.88 MAOA (0.44) MAOAMAOBKCNH2CALML3CYP3A4
SCHEMBL3748036 0.85 MAOB (0.49) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL3759941 0.85 MAOB (0.45) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL13054713 0.85 MAOB (0.49) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL3760724 0.84 MAOB (0.47) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL3758599 0.83 MAOA (0.57) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL13054642 0.83 MAOA (0.57) MAOAMAOBCALML3LMNAPTGS1

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-20100298384-A1 NOVEL OXAZOLIDINONE COMPOUNDS AS ANTIINFECTIVE AGENTS DR. REDDY'S LABORATORIES LTD. (IN) 2010-11-25 US disclosed
US-20100298384-A1 NOVEL OXAZOLIDINONE COMPOUNDS AS ANTIINFECTIVE AGENTS DR. REDDY'S LABORATORIES LTD. (IN) 2010-11-25 US disclosed
WO-2008143649-A2 NOVEL OXAZOLIDINONE COMPOUNDS AS ANTIINFECTIVE AGENTS DR. REDDY'S LABORATORIES LIMITED (IN) 2008-11-27 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-20100298384-A1 NOVEL OXAZOLIDINONE COMPOUNDS AS ANTIINFECTIVE AGENTS OXA1L, MIF, VIP MAOA 3034/4885MAOB 2709/4885KCNH2 4604/4885

“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.