SCHEMBL29801431

SCHEMBL29801431

CC#CCn1c(N(C)C[C@H](C)N)nc2c1c(=O)n(Cc1nc(C)c3ccccc3n1)c(=O)n2C

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.61
FAP Q12884 9/20 0.61
CHRM1 P11229 2/20 0.59
POU2F2 P09086 1/20 0.59
ADORA3 P0DMS8 1/20 0.59
POU2F1 P14859 1/20 0.59
CHRM3 P20309 1/20 0.59
HRH2 P25021 1/20 0.59
MC4R P32245 1/20 0.59
DPP8 Q6V1X1 1/20 0.59
DPP9 Q86TI2 1/20 0.59
GHSR Q92847 1/20 0.59
KCNH2 Q12809 2/20 0.49

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
SCHEMBL4474769 1.00 DPP4 (0.61) DPP4FAPCHRM1POU2F2ADORA3
SCHEMBL196303 1.00 DPP4 (0.61) DPP4FAPCHRM1POU2F2ADORA3
SCHEMBL196304 1.00 DPP4 (0.61) DPP4FAPCHRM1POU2F2ADORA3
SCHEMBL16303655 0.92 DPP4 (0.59) DPP4FAPCHRM1POU2F2ADORA3
SCHEMBL8272340 0.92 DPP4 (0.51) DPP4FAPCHRM1POU2F2ADORA3
SCHEMBL10030473 0.90 DPP4 (0.50) DPP4FAPCHRM1POU2F2ADORA3
SCHEMBL13954913 0.90 DPP4 (0.50) DPP4FAPCHRM1POU2F2ADORA3
SCHEMBL24509008 0.89 DPP4 (0.51) DPP4FAPCHRM1POU2F2ADORA3
SCHEMBL1772436 0.89 DPP4 (0.63) DPP4FAPCHRM1POU2F2ADORA3
SCHEMBL16416909 0.88 DPP4 (0.68) DPP4FAPCHRM1POU2F2ADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2397142-B1 Use of DPP IV inhibitors BOEHRINGER INGELHEIM INT (DE) 2022-07-27 EP claimed
US-20250025470-A1 CARDIO- AND RENOPROTECTIVE ANTIDIABETIC THERAPY BOEHRINGER INGELHEIM INT (DE) 2025-01-23 US disclosed
CN-117547538-A Antidiabetic agents comprising DPP-4 inhibitors (linagliptin) optionally in combination with other antidiabetic agents 勃林格殷格翰国际有限公司 2024-02-13 CN disclosed
EP-4104838-A1 Use of DPP IV inhibitors Boehringer Ingelheim International GmbH (DE) 2022-12-21 EP disclosed
CN-107961377-B Combination therapy 勃林格殷格翰国际有限公司 2022-11-22 CN disclosed
EP-2397142-B1 Use of DPP IV inhibitors BOEHRINGER INGELHEIM INT (DE) 2022-07-27 EP 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-20250025470-A1 CARDIO- AND RENOPROTECTIVE ANTIDIABETIC THERAPY DPP4, DPP3, DPP7 DPP4 1/4885FAP 252/4885CHRM1 3490/4885

“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.