SCHEMBL14935777

SCHEMBL14935777

CC#CCn1c(N2CCCC(NC(=O)OC(C)(C)C)C2)nc2c1c(=O)n(Cc1nc(C)c3ccccc3n1)c(=O)n2C

nearest known ligand 0.83

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.83
FAP Q12884 6/20 0.71
POU2F2 P09086 1/20 0.71
ADORA3 P0DMS8 1/20 0.71
CHRM1 P11229 1/20 0.71
POU2F1 P14859 1/20 0.71
CHRM3 P20309 1/20 0.71
HRH2 P25021 1/20 0.71
MC4R P32245 1/20 0.71
DPP8 Q6V1X1 1/20 0.71
DPP9 Q86TI2 1/20 0.71
GHSR Q92847 1/20 0.71

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
SCHEMBL29576288 1.00 DPP4 (0.83) DPP4FAPPOU2F2ADORA3CHRM1
SCHEMBL639988 1.00 DPP4 (0.83) DPP4FAPPOU2F2ADORA3CHRM1
SCHEMBL637493 1.00 DPP4 (0.83) DPP4FAPPOU2F2ADORA3CHRM1
SCHEMBL3969508 0.94 DPP4 (0.80) DPP4FAPPOU2F2ADORA3CHRM1
SCHEMBL638362 0.94 DPP4 (0.83) DPP4FAPPOU2F2ADORA3CHRM1
SCHEMBL637386 0.94 DPP4 (0.81) DPP4FAPPOU2F2ADORA3CHRM1
SCHEMBL16391894 0.94 DPP4 (0.73) DPP4FAPPOU2F2ADORA3CHRM1
SCHEMBL637743 0.93 DPP4 (0.81) DPP4FAPPOU2F2ADORA3CHRM1
SCHEMBL3548101 0.93 DPP4 (0.73) DPP4FAPPOU2F2ADORA3CHRM1
SCHEMBL636842 0.93 DPP4 (0.81) DPP4FAPPOU2F2ADORA3CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9879011-B2 Amorphous form of linagliptin and process for preparation thereof CADILA HEALTHCARE LIMITED (IN) 2018-01-30 US claimed
US-20150051228-A1 AMORPHOUS FORM OF LINAGLIPTIN AND PROCESS FOR PREPARATION THEREOF CADILA HEALTHCARE LIMITED (IN) 2015-02-19 US claimed
WO-2024074612-A1 A PHARMACEUTICAL INTERMEDIATE ZAKLADY FARMACEUTYCZNE POLPHARMA S.A. (PL) 2024-04-11 WO disclosed
US-9879011-B2 Amorphous form of linagliptin and process for preparation thereof CADILA HEALTHCARE LIMITED (IN) 2018-01-30 US disclosed
US-9593119-B2 Process for the preparation of dipeptidylpeptidase inhibitors GLENMARK PHARMACEUTICALS LIMITED (IN) 2017-03-14 US disclosed
US-9522915-B2 Method for preparing an important intermediate of linagliptin 2Y-CHEM, LTD. (CN) 2016-12-20 US disclosed
US-9522915-B2 Method for preparing an important intermediate of linagliptin 2Y-CHEM, LTD. (CN) 2016-12-20 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-9353114-B2 Process for the preparation of dipeptidylpeptidase inhibitors GLENMARK PHARMACEUTICALS LIMITED (IN) 2016-05-31 US disclosed
US-20150274728-A1 METHOD FOR PREPARING AN IMPORTANT INTERMEDIATE OF LINAGLIPTIN 2Y-CHEM, LTD. (CN) 2015-10-01 US disclosed
US-20150274728-A1 METHOD FOR PREPARING AN IMPORTANT INTERMEDIATE OF LINAGLIPTIN 2Y-CHEM, LTD. (CN) 2015-10-01 US disclosed
US-20150239887-A1 PROCESS FOR THE PREPARATION OF DIPEPTIDYLPEPTIDASE INHIBITORS GLENMARK GENERICS LIMITED (IN) 2015-08-27 US disclosed
US-20150239887-A1 PROCESS FOR THE PREPARATION OF DIPEPTIDYLPEPTIDASE INHIBITORS GLENMARK GENERICS LIMITED (IN) 2015-08-27 US disclosed
US-20150051228-A1 AMORPHOUS FORM OF LINAGLIPTIN AND PROCESS FOR PREPARATION THEREOF CADILA HEALTHCARE LIMITED (IN) 2015-02-19 US disclosed
WO-2013074817-A1 SOLID STATE FORMS OF LINAGLIPTIN ASSIA CHEMICAL INDUSTRIES LTD. (IL) 2013-05-23 WO disclosed
US-20130123282-A1 SOLID STATE FORMS OF LINAGLIPTIN METSGER LEONID (IL) 2013-05-16 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 (5 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 DPP4 1/4885FAP 13/4885POU2F2 2898/4885
US-20160272642-A1 PROCESS FOR THE PREPARATION OF DIPEPTIDYLPEPTIDASE INHIBITORS DPP9, DPP4, DPP7 DPP4 2/4885FAP 19/4885POU2F2 3012/4885
US-20150051228-A1 AMORPHOUS FORM OF LINAGLIPTIN AND PROCESS FOR PREPARATION THEREOF DPP4, PYGL, GID4 DPP4 1/4885FAP 134/4885POU2F2 4164/4885
US-20150274728-A1 METHOD FOR PREPARING AN IMPORTANT INTERMEDIATE OF LINAGLIPTIN DPP4, DPP9, DPP3 DPP4 1/4885FAP 19/4885POU2F2 1566/4885
US-20130123282-A1 SOLID STATE FORMS OF LINAGLIPTIN DPP4, GLP1R, DPP3 DPP4 1/4885FAP 249/4885POU2F2 3308/4885

“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.