SCHEMBL91070

SCHEMBL91070

CNC(=O)c1ccc(CN(CCC(=O)O)C(=O)CCCCCCCCCCCCCCCCC(=O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 7/20 0.55
HDAC6 Q9UBN7 5/20 0.55
HDAC3 O15379 3/20 0.55
HDAC2 Q92769 3/20 0.55
NCOR2 Q9Y618 1/20 0.55
PLK1 P53350 3/20 0.49
MAPK1 P28482 1/20 0.47
HDAC4 P56524 2/20 0.46
HDAC7 Q8WUI4 2/20 0.46
HDAC10 Q969S8 2/20 0.46
HDAC11 Q96DB2 2/20 0.46
HDAC8 Q9BY41 2/20 0.46
HDAC9 Q9UKV0 2/20 0.46
HDAC5 Q9UQL6 2/20 0.46
KDM4A O75164 3/20 0.45
KDM4C Q9H3R0 3/20 0.45
KDM5A P29375 1/20 0.44
PHF8 Q9UPP1 1/20 0.44
KDM2A Q9Y2K7 1/20 0.44
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL34460422 0.87 HDAC1 (0.52) HDAC1HDAC6HDAC3HDAC2NCOR2
SCHEMBL13973931 0.85 HDAC6 (0.57) HDAC1HDAC6HDAC3HDAC2NCOR2
SCHEMBL13973975 0.81 MAPK1 (0.51) HDAC1HDAC6HDAC3HDAC2NCOR2
SCHEMBL557851 0.80 KDM4A (0.45) HDAC1HDAC6HDAC3HDAC2NCOR2
SCHEMBL1363599 0.80 KDM4A (0.45) HDAC1HDAC6HDAC3HDAC2NCOR2
SCHEMBL558153 0.80 KDM4A (0.45) HDAC1HDAC6HDAC3HDAC2NCOR2
SCHEMBL557852 0.80 KDM4A (0.45) HDAC1HDAC6HDAC3HDAC2NCOR2
SCHEMBL1363597 0.80 KDM4A (0.45) HDAC1HDAC6HDAC3HDAC2NCOR2
SCHEMBL4959492 0.80 KDM4A (0.45) HDAC1HDAC6HDAC3HDAC2NCOR2
SCHEMBL4959483 0.80 KDM4A (0.45) HDAC1HDAC6HDAC3HDAC2NCOR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129343-B2 Acylated GLP-1 compounds NOVO NORDISK A/S (DK) 2012-03-06 US disclosed
US-20090156478-A1 Acylated GLP-1 Compounds NOVO NORDISK A/S (DK) 2009-06-18 US disclosed
US-20090156478-A1 Acylated GLP-1 Compounds NOVO NORDISK A/S (DK) 2009-06-18 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-20090156478-A1 Acylated GLP-1 Compounds GLP1R, GIPR, GCGR HDAC1 393/4885HDAC6 227/4885HDAC3 307/4885

“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.