SCHEMBL13236367

SCHEMBL13236367

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

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALB P02768 3/20 0.60
▸ FOLH1 Q04609 3/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ NOD1 Q9Y239 2/20 0.46
▸ SIRT6 Q8N6T7 1/20 0.45
▸ SIRT1 Q96EB6 1/20 0.45
▸ SIRT5 Q9NXA8 2/20 0.43
▸ GNPAT O15228 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ PTGS2 P35354 1/20 0.42
▸ THPO P40225 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ GLP1R P43220 3/20 0.42
▸ ALDH1A1 P00352 1/20 0.41

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
SCHEMBL13057101 0.92 FOLH1 (0.55) ALBFOLH1NOD1GNPATGLP1R
SCHEMBL23451113 0.87 FOLH1 (0.63) ALBFOLH1SMN1; SMN2NOD1SIRT6
SCHEMBL13286041 0.87 ALB (0.62) ALBFOLH1SMN1; SMN2NOD1SIRT6
SCHEMBL21078712 0.85 NOD1 (0.56) ALBFOLH1NOD1GNPATGLP1R
SCHEMBL21078710 0.85 NOD1 (0.56) ALBFOLH1NOD1GNPATGLP1R
SCHEMBL19069648 0.84 ALB (0.56) ALBFOLH1SMN1; SMN2NOD1SIRT6
SCHEMBL15871316 0.84 ALB (0.56) ALBFOLH1SMN1; SMN2NOD1SIRT6
SCHEMBL25542879 0.84 NOD1 (0.65) ALBFOLH1NOD1SIRT6SIRT1
SCHEMBL2735591 0.84 FOLH1 (0.71) ALBFOLH1SMN1; SMN2SIRT6SIRT1
SCHEMBL16393150 0.84 FOLH1 (0.71) ALBFOLH1SMN1; SMN2SIRT6SIRT1

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 2 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-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 ALB 366/4885FOLH1 1314/4885SMN1; SMN2 4789/4885

“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.

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