SCHEMBL5428231

SCHEMBL5428231

N#Cc1ccc(N2C(=O)OC[C@H]2c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.46
TNKS2 Q9H2K2 1/20 0.46
HDAC6 Q9UBN7 3/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
QPCT Q16769 1/20 0.44
IDH1 O75874 13/20 0.43
HTR7 P34969 1/20 0.40

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
SCHEMBL5428237 1.00 TNKS (0.46) TNKSTNKS2HDAC6HDAC1HDAC8
SCHEMBL5430336 0.85 QPCT (0.51) TNKSTNKS2HDAC6HDAC1HDAC8
SCHEMBL5431723 0.85 QPCT (0.51) TNKSTNKS2HDAC6HDAC1HDAC8
SCHEMBL5430340 0.85 QPCT (0.51) TNKSTNKS2HDAC6HDAC1HDAC8
SCHEMBL14502326 0.81 IDH1 (0.51) TNKSTNKS2HDAC6HDAC1HDAC8
SCHEMBL5429899 0.81 IDH1 (0.51) TNKSTNKS2HDAC6HDAC1HDAC8
SCHEMBL19745746 0.81 HDAC6 (0.53) HDAC6HDAC1HDAC8HTR7
SCHEMBL19745745 0.81 HDAC6 (0.53) HDAC6HDAC1HDAC8HTR7
SCHEMBL14556222 0.79 TNKS (0.57) TNKSTNKS2HDAC6HDAC1HDAC8
SCHEMBL14556224 0.79 TNKS (0.57) TNKSTNKS2HDAC6HDAC1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7223870-B2 Methods for preparing N-arylated oxazolidinones via a copper catalyzed cross coupling reaction PFIZER INC. (US) 2007-05-29 US disclosed
US-7223870-B2 Methods for preparing N-arylated oxazolidinones via a copper catalyzed cross coupling reaction PFIZER INC. (US) 2007-05-29 US disclosed
US-20070049759-A1 Methods for Preparing N-Arylated Oxazolidinones Via A Copper Catalyzed Cross Coupling PFIZER INC 2007-03-01 US disclosed
US-20070049759-A1 Methods for Preparing N-Arylated Oxazolidinones Via A Copper Catalyzed Cross Coupling PFIZER INC 2007-03-01 US disclosed
US-20070049759-A1 Methods for Preparing N-Arylated Oxazolidinones Via A Copper Catalyzed Cross Coupling PFIZER INC 2007-03-01 US disclosed
EP-1562916-A1 METHODS FOR PREPARING N-ARYLATED OXAZOLIDINONES VIA A COPPER CATALYZED CROSS COUPLING REACTION Pfizer Products Inc. (US) 2005-08-17 EP disclosed
WO-2004039788-A1 METHODS FOR PREPARING N-ARYLATED OXAZOLIDINONES VIA A COPPER CATALYZED CROSS COUPLING REACTION PFIZER PRODUCTS INC. (US) 2004-05-13 WO 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-20070049759-A1 Methods for Preparing N-Arylated Oxazolidinones Via A Copper Catalyzed Cross Coupling AOC2, SOD1, AOC3 TNKS 1391/4885TNKS2 1486/4885HDAC6 2166/4885

“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.