SCHEMBL3038798

SCHEMBL3038798

COC(=O)[C@H]1CN(c2ccc3c(c2)C[C@@H](C)N3C(=O)CO)C(=O)O1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 4/20 0.38
NOD2 Q9HC29 4/20 0.38
NOD1 Q9Y239 4/20 0.38
TP53 P04637 2/20 0.37
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
GAA P10253 1/20 0.37
LMNA P02545 1/20 0.37
PTGS1 P23219 1/20 0.37
CALML3 P27482 1/20 0.37
SDHA P31040 1/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
ALDH1A1 P00352 3/20 0.37
F10 P00742 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
POLB P06746 1/20 0.36
PABPC1 P11940 1/20 0.36
EIF4H Q15056 1/20 0.36
KDM4E B2RXH2 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
SCHEMBL3042601 0.90 TNF (0.38) TNFNOD2NOD1TP53MAOA
SCHEMBL5766142 0.89 TNF (0.41) TNFNOD2NOD1TP53MAOA
SCHEMBL3043509 0.89 MAOA (0.44) TNFNOD2NOD1TP53MAOA
SCHEMBL3039182 0.86 SMN1; SMN2 (0.39) TP53GAALMNANPC1RAB9A
SCHEMBL3029320 0.83 MAOB (0.36) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6040246 0.80 MAOA (0.59) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6970806 0.80 MAOA (0.59) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6965187 0.80 MAOA (0.59) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6040353 0.79 MAOB (0.53) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL5766006 0.77 SMN1; SMN2 (0.40) TP53GAALMNANPC1RAB9A

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 TNF 4331/4885NOD2 155/4885NOD1 290/4885

“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.