SCHEMBL13236359

SCHEMBL13236359

COC(=O)CC[C@H](NC(=O)CCC(C)=O)C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
POLB P06746 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
ALOX5 P09917 1/20 0.41
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 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
SCHEMBL13236361 0.90 POLB (0.59) KMT2APOLBL3MBTL1CA12CA1
SCHEMBL28790680 0.88 L3MBTL1 (0.54) KMT2APOLBL3MBTL1CA12CA1
SCHEMBL28790681 0.88 L3MBTL1 (0.54) KMT2APOLBL3MBTL1CA12CA1
SCHEMBL13236356 0.87 KMT2A (0.43) KMT2APOLBL3MBTL1
SCHEMBL16199279 0.87 KMT2A (0.50) KMT2APOLBL3MBTL1CA12CA1
SCHEMBL17384477 0.87 KMT2A (0.50) KMT2APOLBL3MBTL1CA12CA1
SCHEMBL24708583 0.86 KMT2A (0.56) KMT2APOLB
SCHEMBL13660497 0.83 L3MBTL1 (0.56) KMT2APOLBL3MBTL1CA12CA1
SCHEMBL463421 0.82 CA12 (0.48) KMT2APOLBL3MBTL1CA12CA1
SCHEMBL468764 0.82 CA12 (0.48) KMT2APOLBL3MBTL1CA12CA1

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-7759357-B2 Phenylpyrimidine amines as IgE inhibitors NOVARTIS AG (CH) 2010-07-20 US disclosed
US-7759357-B2 Phenylpyrimidine amines as IgE inhibitors NOVARTIS AG (CH) 2010-07-20 US disclosed
EP-1474146-B1 PHENYLPYRIMIDINE AMINES AS IGE INHIBITORS NOVARTIS AG (CH) 2008-08-27 EP disclosed
US-20070281956-A1 Phenylpyrimidine amines as IgE inhibitors NOVARTIS AG (CH) 2007-12-06 US disclosed
US-20070281956-A1 Phenylpyrimidine amines as IgE inhibitors NOVARTIS AG (CH) 2007-12-06 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 (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-20070281956-A1 Phenylpyrimidine amines as IgE inhibitors FCER2, SELP, FCGR2A KMT2A 602/4885POLB 2615/4885L3MBTL1 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.