SCHEMBL4967075

SCHEMBL4967075

N[C@H]1CCCN(P(N)(=O)N2CCCC2C(=O)O)C1=O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.49
ACE P12821 6/20 0.35
MVD P53602 2/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPT P10636 1/20 0.33
APEX1 P27695 1/20 0.33
CA2 P00918 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL4964392 0.80 DPP4 (0.44) DPP4
SCHEMBL4990086 0.74 DPP4 (0.57) DPP4CYP3A4TSHRTDP1MAPT
SCHEMBL4965090 0.73 DPP4 (0.78) DPP4CYP3A4TSHRTDP1MAPT
SCHEMBL4965369 0.73 DPP4 (0.78) DPP4CYP3A4TSHRTDP1MAPT
Hydrochloric Acid SCHEMBL387479 0.72 DPP4 (0.75) DPP4CYP3A4TSHRTDP1MAPT
Hydrochloric Acid SCHEMBL387480 0.72 DPP4 (0.75) DPP4CYP3A4TSHRTDP1MAPT
SCHEMBL6529721 0.70 ACE (0.44) DPP4ACECYP3A4TSHRTDP1
SCHEMBL8318471 0.70 ACE (0.44) DPP4ACECYP3A4TSHRTDP1
SCHEMBL645595 0.70 ACE (0.44) DPP4ACECYP3A4TSHRTDP1
SCHEMBL7349193 0.70 ACE (0.44) DPP4ACECYP3A4TSHRTDP1

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 8/4885ACE 63/4885MVD 1151/4885

“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.