SCHEMBL4966573

SCHEMBL4966573

NP(N)(=O)N1CCC[C@H](NCc2ccccc2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
FABP6 P51161 1/20 0.41
ROCK2 O75116 1/20 0.40
BCHE P06276 2/20 0.40
ACHE P22303 2/20 0.40
BACE1 P56817 2/20 0.40
DPP4 P27487 1/20 0.39
ACE P12821 2/20 0.38
POLB P06746 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
MME P08473 1/20 0.36
XIAP P98170 1/20 0.36
GAA P10253 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
SCHEMBL4965377 0.87 POLB (0.43) ALDH1A1BCHEACHEBACE1DPP4
SCHEMBL4963484 0.84 MEN1 (0.52) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL4965960 0.84 DPP4 (0.36) ROCK2DPP4
SCHEMBL4968365 0.82 KDM4E (0.39) ALDH1A1DPP4ACE
SCHEMBL4965947 0.80 USP2 (0.46) ALDH1A1POLBKMT2AHSD17B10
SCHEMBL4963843 0.80 CA1 (0.42) ALDH1A1ROCK2DPP4SMN1; SMN2KMT2A
SCHEMBL4077352 0.77 CASP3 (0.52) ALDH1A1DPP4GAA
SCHEMBL4077350 0.77 CASP3 (0.52) ALDH1A1DPP4GAA
SCHEMBL4078596 0.77 CASP3 (0.52) ALDH1A1DPP4GAA
SCHEMBL4963779 0.77 DPP4 (0.41) DPP4ACEMME

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 ALDH1A1 1438/4885FABP6 2134/4885ROCK2 4837/4885

“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.