SCHEMBL3043058

SCHEMBL3043058

CCNC(=O)[C@H]1CN(c2ccc3c(c2)CCCc2c(CC)n[nH]c2-3)C(=O)O1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 5/20 0.35
MAOA P21397 4/20 0.34
MGLL Q99685 1/20 0.34
HTR6 P50406 2/20 0.33
CALML3 P27482 1/20 0.33

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
SCHEMBL3042653 0.92 MAOA (0.33) PARP1MAOAMGLLHTR6CALML3
SCHEMBL3029202 0.92 MAOA (0.39) PARP1MAOAHTR6CALML3
SCHEMBL3045804 0.90 HTR6 (0.35) MAOAHTR6CALML3
SCHEMBL3039317 0.89 MAOA (0.34) PARP1MAOAHTR6CALML3
SCHEMBL6239191 0.86 MAOA (0.50) MAOACALML3
SCHEMBL6239193 0.86 MAOA (0.50) MAOACALML3
SCHEMBL3038266 0.85 MAOA (0.36) PARP1MAOAHTR6CALML3
SCHEMBL13515900 0.84 HTR6 (0.32) MAOAHTR6
SCHEMBL3038298 0.84 HSP90AA1 (0.38) MAOAHTR6CALML3
SCHEMBL6236832 0.81 MAOA (0.49) MAOACALML3

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 5 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-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 PARP1 1480/4885MAOA 957/4885MGLL 2750/4885
US-20070015801-A1 N-aryl-2-oxazolidinone-5-carboxamides and their derivatives OXA1L, AADAC, MT-ND5 PARP1 1480/4885MAOA 957/4885MGLL 2750/4885

“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.