SCHEMBL4966920

SCHEMBL4966920

COC(=O)c1ccc(NP(N)(=O)N2CCC[C@H](N)C2=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.50
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 3/20 0.40
HPGD P15428 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 2/20 0.39
EPHX2 P34913 1/20 0.39
CDC25A P30304 1/20 0.39
CDC25B P30305 1/20 0.39
CYP2C19 P33261 1/20 0.39
TSHR P16473 2/20 0.39
MAPK1 P28482 1/20 0.39
MAPT P10636 1/20 0.38

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
SCHEMBL4966659 0.85 DPP4 (0.50) DPP4HPGDSMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4964917 0.83 DPP4 (0.56) DPP4MEN1KMT2AL3MBTL1HPGD
SCHEMBL4968301 0.83 DPP4 (0.46) DPP4KMT2AHPGD
SCHEMBL4966944 0.82 DPP4 (0.54) DPP4RAB9A
SCHEMBL4966724 0.81 DPP4 (0.53) DPP4NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4963531 0.80 DPP4 (0.56) DPP4KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL4965133 0.78 DPP4 (0.50) DPP4NPC1RAB9A
SCHEMBL4964315 0.77 DPP4 (0.50) DPP4KMT2ANPC1HPGDRAB9A
SCHEMBL4964297 0.77 DPP4 (0.49) DPP4MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL4965459 0.74 DPP4 (0.42) DPP4NPC1RAB9ASMN1; SMN2ALDH1A1

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 8/4885MEN1 2936/4885KMT2A 884/4885

“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.