SCHEMBL4268951

SCHEMBL4268951

C[C@H](NOC1CCCCC1)C(=O)OP(N)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.36
CA12 O43570 5/20 0.36
CA1 P00915 5/20 0.36
CA2 P00918 5/20 0.36
CA9 Q16790 5/20 0.36
MMP8 P22894 4/20 0.35
MMP1 P03956 3/20 0.35
ANPEP P15144 2/20 0.33
ERAP2 Q6P179 2/20 0.33
METAP2 P50579 2/20 0.32
NPSR1 Q6W5P4 1/20 0.31
CYP19A1 P11511 1/20 0.31
MMP3 P08254 2/20 0.31
MMP9 P14780 1/20 0.31
EPHX1 P07099 1/20 0.31
ACE P12821 1/20 0.31
METAP1 P53582 1/20 0.30

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
SCHEMBL4266943 1.00 MMP2 (0.36) MMP2CA12CA1CA2CA9
SCHEMBL4265150 1.00 MMP2 (0.36) MMP2CA12CA1CA2CA9
SCHEMBL7027254 0.88 MMP2 (0.37) MMP2CA12CA1CA2CA9
SCHEMBL27574167 0.86 MMP2 (0.35) MMP2CA12CA1CA2CA9
SCHEMBL12477720 0.85 MMP2 (0.36) MMP2CA12CA1CA2CA9
SCHEMBL28646794 0.85 MMP2 (0.36) MMP2CA12CA1CA2CA9
SCHEMBL12477242 0.84 CA12 (0.33) MMP2CA12CA1CA2CA9
SCHEMBL12477609 0.81 ACE (0.34) MMP2CA12CA1CA2CA9
Phosphoric Acid SCHEMBL28317933 0.77 MMP2 (0.38) MMP2CA12CA1CA2CA9
SCHEMBL4269654 0.76 KDM4E (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069268-A1 NOVEL PHOSPHORAMIDATE COMPOUNDS AND METHODS OF USE CELMED ONCOLOGY (USA), INC. 2009-03-12 US disclosed
US-7462605-B2 Phosphoramidate compounds and methods of use CELMED ONCOLOGY (USA), INC. (CA) 2008-12-09 US disclosed
US-20030109697-A1 Novel phosphoramidate compounds and methods of use KIADIS PHARMA INTELLECTUAL PROPERTY B.V. (NL) 2003-06-12 US 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 (2 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-20090069268-A1 NOVEL PHOSPHORAMIDATE COMPOUNDS AND METHODS OF USE MTAP, TYMP, INPP5D MMP2 4569/4885CA12 2604/4885CA1 2676/4885
US-20030109697-A1 Novel phosphoramidate compounds and methods of use MTAP, INPP5D, TYMP MMP2 4681/4885CA12 2682/4885CA1 2801/4885

“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.