SCHEMBL4964481

SCHEMBL4964481

N[C@H]1CCCN(P(N)(=O)NCc2ccccc2)C1=O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.52
ENO1 P06733 2/20 0.39
ALDH1A1 P00352 4/20 0.37
HRH3 Q9Y5N1 1/20 0.37
POLB P06746 1/20 0.36
BCHE P06276 2/20 0.36
ACHE P22303 2/20 0.36
BACE1 P56817 2/20 0.36
FABP6 P51161 1/20 0.36
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
PKM P14618 1/20 0.35
CYP2C19 P33261 1/20 0.35
CXCR4 P61073 1/20 0.35

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
SCHEMBL4965226 0.88 DPP4 (0.44) DPP4ENO1ALDH1A1HRH3POLB
SCHEMBL4965260 0.86 DPP4 (0.46) DPP4ALDH1A1HRH3CYP2C9PKM
SCHEMBL4967596 0.81 DPP4 (0.51) DPP4MEN1KMT2A
SCHEMBL4963531 0.80 DPP4 (0.56) DPP4ALDH1A1POLBBCHEHTT
SCHEMBL4966610 0.79 DPP4 (0.49) DPP4ALDH1A1MEN1KMT2APKM
SCHEMBL4965777 0.77 DPP4 (0.59) DPP4CYP3A4
SCHEMBL4967906 0.77 DPP4 (0.55) DPP4ALDH1A1POLBHTT
SCHEMBL4968360 0.76 DPP4 (0.57) DPP4CYP3A4
SCHEMBL4966621 0.75 ALDH1A1 (0.42) DPP4ALDH1A1HRH3POLBCYP2C9
SCHEMBL4967227 0.74 DPP4 (0.52) DPP4ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1489088-B1 NOVEL ALPHA-AMINO-N-(DIAMINOPHOSPHINYL)LACTAM DERIVATIVE NIPPON KAYAKU KK (JP) 2008-08-13 EP disclosed
US-7348318-B2 α-Amino-N-(diaminophosphinyl)lactam derivatives NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2008-03-25 US disclosed
US-20050164989-A1 Novel $g(a)-amino-n-(diaminophosphinyl) lactam derivative NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2005-07-28 US disclosed
EP-1489088-A1 NOVEL ALPHA-AMINO-N-(DIAMINOPHOSPHINYL)LACTAM DERIVATIVE Nippon Kayaku Kabushiki Kaisha (JP) 2004-12-22 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-20050164989-A1 Novel $g(a)-amino-n-(diaminophosphinyl) lactam derivative DNPEP, PEPD, ANPEP DPP4 8/4885ENO1 1893/4885ALDH1A1 1438/4885

“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.