SCHEMBL4560377

SCHEMBL4560377

O=C1OC(Oc2ccccn2)C(=O)N1Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.40
TACR1 P25103 1/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
ELANE P08246 2/20 0.38
CTSG P08311 2/20 0.38
F2 P00734 1/20 0.38
PLG P00747 1/20 0.38
CMA1 P23946 1/20 0.38
CTRC Q99895 1/20 0.38
ALDH1A1 P00352 5/20 0.38
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
GSK3A P49840 2/20 0.36
GSK3B P49841 2/20 0.36
MGLL Q99685 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 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
SCHEMBL3625933 0.81 EP300 (0.46) EP300TACR1KMT2AMEN1ELANE
SCHEMBL25800349 0.65 ALDH1A1 (0.53) EP300KMT2AMEN1ELANECTSG
SCHEMBL5300149 0.65 ROCK1 (0.56) GAASMN1; SMN2
SCHEMBL31226135 0.62 TACR1 (0.55) EP300TACR1KMT2AMEN1ELANE
SCHEMBL16775234 0.61 KMT2A (0.70) EP300KMT2AMEN1ELANECTSG
SCHEMBL16759895 0.61 KMT2A (0.70) EP300KMT2AMEN1ELANECTSG
SCHEMBL9438388 0.61 PARP1 (0.48) KMT2AMEN1ALDH1A1GAAGSK3B
SCHEMBL14577578 0.61 CHRM5 (0.59) KMT2AMEN1ALDH1A1CHRM5
SCHEMBL18306073 0.60 MEN1 (0.49) EP300KMT2AMEN1ELANECTSG
SCHEMBL28155521 0.60 ELANE (0.47) EP300TACR1KMT2AMEN1ELANE

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-20090069385-A1 Antidiabetic Oxazolidinediones and Thiazolidinediones MERCK SHARP & DOHME CORP. 2009-03-12 US disclosed
US-20090069385-A1 Antidiabetic Oxazolidinediones and Thiazolidinediones MERCK SHARP & DOHME CORP. 2009-03-12 US disclosed
EP-1909789-A2 ANTIDIABETIC OXAZOLIDINEDIONES AND THIAZOLIDINEDIONES Merck & Co., Inc. (US) 2008-04-16 EP disclosed
EP-1909789-A2 ANTIDIABETIC OXAZOLIDINEDIONES AND THIAZOLIDINEDIONES Merck & Co., Inc. (US) 2008-04-16 EP disclosed
WO-2007018956-A3 ANTIDIABETIC OXAZOLIDINEDIONES AND THIAZOLIDINEDIONES MERCK & CO INC (US) 2007-04-12 WO disclosed
WO-2007018956-A2 ANTIDIABETIC OXAZOLIDINEDIONES AND THIAZOLIDINEDIONES MERCK & CO., INC. (US) 2007-02-15 WO disclosed
WO-2007018956-A2 ANTIDIABETIC OXAZOLIDINEDIONES AND THIAZOLIDINEDIONES MERCK & CO., INC. (US) 2007-02-15 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-20090069385-A1 Antidiabetic Oxazolidinediones and Thiazolidinediones PPARD, PPARA, PPARG EP300 1262/4885TACR1 2644/4885KMT2A 1608/4885

“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.