SCHEMBL3043449

SCHEMBL3043449

CC1[C@H](C(=O)O)OC(=O)N1c1ccc(C2=CCSCC2)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 13/20 0.37
CALML3 P27482 3/20 0.33
MAOB P27338 1/20 0.31
HDAC1 Q13547 2/20 0.30
HDAC8 Q9BY41 2/20 0.30
HDAC6 Q9UBN7 2/20 0.30
HDAC5 Q9UQL6 1/20 0.30
FADS1 O60427 1/20 0.30

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
SCHEMBL3038586 0.79 MAOA (0.45) MAOACALML3MAOB
SCHEMBL3043443 0.75 MAOA (0.43) MAOAMAOBFADS1
SCHEMBL3043447 0.74 MAOA (0.47) MAOACALML3MAOB
SCHEMBL3043513 0.73 FADS1 (0.36) CALML3FADS1
SCHEMBL6365509 0.73 CALML3 (0.61) MAOACALML3MAOB
SCHEMBL5232769 0.73 CALML3 (0.61) MAOACALML3MAOB
SCHEMBL1176420 0.72 MAOA (0.71) MAOACALML3MAOB
SCHEMBL1176417 0.72 MAOA (0.71) MAOACALML3MAOB
SCHEMBL3043319 0.71 MAOA (0.40) MAOAMAOBFADS1
SCHEMBL6403061 0.68 MAOA (0.47) MAOACALML3MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7645781-B2 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives PFIZER INC (US) 2010-01-12 US disclosed
US-20070015801-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives THOMAS RICHARD C 2007-01-18 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 (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-20070015801-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives OXA1L, AADAC, MT-ND5 MAOA 957/4885CALML3 3149/4885MAOB 976/4885

“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.