SCHEMBL4968959

SCHEMBL4968959

Cc1ccccc1COC(=O)N[C@H]1CCCN(P(N)(N)=O)C1=O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.41
CASP3 P42574 1/20 0.41
GRIN2B Q13224 1/20 0.39
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
EPHX1 P07099 1/20 0.38
FFAR1 O14842 1/20 0.38
POLB P06746 1/20 0.38
CASP1 P29466 1/20 0.37
DPP4 P27487 1/20 0.37
FAP Q12884 1/20 0.37
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
XIAP P98170 1/20 0.37
BIRC2 Q13490 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
EPHX2 P34913 1/20 0.36

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
SCHEMBL4968441 0.88 CASP3 (0.44) NAAACASP3CASP1DPP4
SCHEMBL4967287 0.88 NAAA (0.40) NAAACASP3EPHX1CASP1DPP4
SCHEMBL4966416 0.87 NAAA (0.40) NAAACASP3ALDH1A1EPHX1CASP1
SCHEMBL4964957 0.86 NAAA (0.40) NAAACASP3EPHX1CASP1
SCHEMBL4077352 0.85 CASP3 (0.52) NAAACASP3ALDH1A1EPHX1CASP1
SCHEMBL4078596 0.85 CASP3 (0.52) NAAACASP3ALDH1A1EPHX1CASP1
SCHEMBL4077350 0.85 CASP3 (0.52) NAAACASP3ALDH1A1EPHX1CASP1
SCHEMBL4964953 0.84 CASP3 (0.38) NAAACASP3ALDH1A1EPHX1POLB
SCHEMBL4082421 0.82 CASP3 (0.56) NAAACASP3ALDH1A1EPHX1CASP1
SCHEMBL4086471 0.82 CASP3 (0.56) NAAACASP3ALDH1A1EPHX1CASP1

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 NAAA 57/4885CASP3 1464/4885GRIN2B 830/4885

“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.