SCHEMBL3044455

SCHEMBL3044455

CNC(=O)[C@H]1CN(c2cc(F)c3c(c2)CCCc2cnoc2-3)C(=O)O1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.41
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34
CALML3 P27482 4/20 0.34
MAOB P27338 3/20 0.33
LMNA P02545 1/20 0.33
PTGS1 P23219 1/20 0.33
SDHA P31040 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
F10 P00742 1/20 0.32

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
SCHEMBL3036093 0.90 MAOA (0.41) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3034795 0.89 MAOA (0.53) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3048209 0.83 MAOA (0.35) MAOACALML3MAOBCYP3A4CYP2C19
SCHEMBL3039668 0.83 MAOA (0.40) MAOAGRIN1GRIN2BCALML3
SCHEMBL3043311 0.82 MAOA (0.32) MAOAGRIN1GRIN2BMAOB
SCHEMBL6483545 0.81 MAOA (0.55) MAOACALML3MAOBLMNAPTGS1
SCHEMBL6483552 0.81 MAOA (0.55) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3035192 0.79 MAOA (0.37) MAOAGRIN1GRIN2B
SCHEMBL3038113 0.78 MAOA (0.38) MAOAGRIN1GRIN2BCALML3MAOB
SCHEMBL3042073 0.77 MAOA (0.36) MAOAGRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040147760-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives PHARMACIA & UPJOHN COMPANY 2004-07-29 US claimed
US-7645781-B2 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives PFIZER INC (US) 2010-01-12 US disclosed
US-7645781-B2 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives PFIZER INC (US) 2010-01-12 US disclosed
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
US-20070015801-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives THOMAS RICHARD C 2007-01-18 US disclosed
US-20070015801-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives THOMAS RICHARD C 2007-01-18 US disclosed
US-7141588-B2 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives PFIZER, INC. (US) 2006-11-28 US disclosed
US-20040147760-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives PHARMACIA & UPJOHN COMPANY 2004-07-29 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 (2 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-20040147760-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives OXA1L, AADAC, MT-ND5 MAOA 957/4885GRIN1 1767/4885GRIN2B 888/4885
US-20070015801-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives OXA1L, AADAC, MT-ND5 MAOA 957/4885GRIN1 1767/4885GRIN2B 888/4885

“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.