SCHEMBL15519472

SCHEMBL15519472

CC#CCCn1c(Br)nc2[nH]c(=O)[nH]c(=O)c21

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
GDA Q9Y2T3 1/20 0.37
NOD1 Q9Y239 1/20 0.35
MAPT P10636 2/20 0.35
MAPK1 P28482 3/20 0.34
DPP4 P27487 1/20 0.34
RECQL P46063 1/20 0.34
MDM2 Q00987 1/20 0.34
ALDH1A1 P00352 3/20 0.33
POLB P06746 2/20 0.33
LMNA P02545 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HPGD P15428 1/20 0.33
BRDT Q58F21 1/20 0.31
GAA P10253 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL18989874 0.73 GDA (0.47) KDM4EGDANOD1MAPTMAPK1
SCHEMBL3690781 0.72 GDA (0.36) GDANOD1MAPTDPP4BRDT
SCHEMBL15519474 0.68 DPP4 (0.40) KDM4EMAPTMAPK1DPP4RECQL
SCHEMBL23730754 0.66 GDA (0.40) KDM4EGDANOD1MAPTDPP4
SCHEMBL497538 0.65 KDM4E (0.62) KDM4EMAPTMAPK1RECQLMDM2
SCHEMBL30241271 0.64 DPP4 (0.30) NOD1DPP4
SCHEMBL9844556 0.64 NOD1 (0.44) KDM4EGDANOD1MAPK1DPP4
SCHEMBL3902925 0.63 KDM4E (0.46) KDM4EGDANOD1DPP4HPGD
SCHEMBL9387992 0.62 GDA (0.36) GDANOD1DPP4BRDT
SCHEMBL835443 0.62 DPP4 (0.40) GDANOD1DPP4ALDH1A1POLB

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
EP-2885302-B1 PROCESS FOR THE PREPARATION OF DIPEPTIDYLPEPTIDASE INHIBITORS GLENMARK PHARMACEUTICALS LTD (IN) 2018-03-07 EP disclosed
US-9593119-B2 Process for the preparation of dipeptidylpeptidase inhibitors GLENMARK PHARMACEUTICALS LIMITED (IN) 2017-03-14 US disclosed
US-20160272642-A1 PROCESS FOR THE PREPARATION OF DIPEPTIDYLPEPTIDASE INHIBITORS GLENMARK LIFE SCIENCES LIMITED (IN) 2016-09-22 US disclosed
US-9353114-B2 Process for the preparation of dipeptidylpeptidase inhibitors GLENMARK PHARMACEUTICALS LIMITED (IN) 2016-05-31 US disclosed
US-20150239887-A1 PROCESS FOR THE PREPARATION OF DIPEPTIDYLPEPTIDASE INHIBITORS GLENMARK GENERICS LIMITED (IN) 2015-08-27 US disclosed
EP-2885302-A2 PROCESS FOR THE PREPARATION OF DIPEPTIDYLPEPTIDASE INHIBITORS Glenmark Pharmaceuticals Limited (IN) 2015-06-24 EP disclosed
WO-2014033746-A2 PROCESS FOR THE PREPARATION OF DIPEPTIDYLPEPTIDASE INHIBITORS GLENMARK PHARMACEUTICALS LIMITED; GLENMARK GENERICS LIMITED (IN) 2014-03-06 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 (2 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-20150239887-A1 PROCESS FOR THE PREPARATION OF DIPEPTIDYLPEPTIDASE INHIBITORS DPP4, DPP9, DPP3 KDM4E 702/4885GDA 3792/4885NOD1 1540/4885
US-20160272642-A1 PROCESS FOR THE PREPARATION OF DIPEPTIDYLPEPTIDASE INHIBITORS DPP9, DPP4, DPP7 KDM4E 927/4885GDA 4417/4885NOD1 1290/4885

“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.