SCHEMBL4150435

SCHEMBL4150435

[2H]C1([2H])CN(c2ccc(N3C[C@H](CCl)OC3=O)cc2F)CC([2H])([2H])O1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.56
MAOA P21397 5/20 0.56
LMNA P02545 1/20 0.56
PTGS1 P23219 1/20 0.56
CALML3 P27482 1/20 0.56
SDHA P31040 1/20 0.56
F10 P00742 7/20 0.52

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
SCHEMBL13316509 0.89 MAOB (0.58) MAOBMAOALMNAPTGS1CALML3
SCHEMBL4156655 0.89 MAOB (0.56) MAOBMAOALMNAPTGS1CALML3
SCHEMBL16617380 0.89 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL2583967 0.89 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL2872739 0.89 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL4167187 0.83 MAOB (0.53) MAOBMAOALMNAPTGS1CALML3
Linezolid SCHEMBL13316499 0.83 MAOB (0.82) MAOBMAOALMNAPTGS1CALML3
SCHEMBL15341644 0.82 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
Linezolid SCHEMBL13316503 0.82 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL12176864 0.78 MAOB (0.70) MAOBMAOALMNAPTGS1CALML3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8796267-B2 Oxazolidinone derivatives and methods of use CONCERT PHARMACEUTICALS, INC. (US) 2014-08-05 US disclosed
US-20130281456-A1 SYNTHESIS OF DEUTERATED MORPHOLINE DERIVATIVES LIU JULIE F (US) 2013-10-24 US disclosed
US-8354557-B2 Synthesis of deuterated morpholine derivatives CONCERT PHARMACEUTICALS, INC. (US) 2013-01-15 US disclosed
US-20100160247-A1 Synthesis of deuterated morpholine derivatives CONCERT PHARMACEUTICALS, INC. (US) 2010-06-24 US disclosed
US-20090093422-A1 Oxazolidinone derivatives and methods of use SUN PHARMACEUTICAL INDUSTRIES, INC. 2009-04-09 US disclosed
US-20090093422-A1 Oxazolidinone derivatives and methods of use SUN PHARMACEUTICAL INDUSTRIES, INC. 2009-04-09 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 (3 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-20090093422-A1 Oxazolidinone derivatives and methods of use OXA1L, AQP4, AQP3 MAOB 964/4885MAOA 968/4885LMNA 2912/4885
US-20130281456-A1 SYNTHESIS OF DEUTERATED MORPHOLINE DERIVATIVES DRD4, DRD1, DRD2 MAOB 1448/4885MAOA 2151/4885LMNA 2689/4885
US-20100160247-A1 Synthesis of deuterated morpholine derivatives DRD4, DRD1, DRD2 MAOB 1448/4885MAOA 2151/4885LMNA 2689/4885

“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.