SCHEMBL5652214

SCHEMBL5652214

O=C(O)CCCCCNC(=O)[C@H](CCCNC(=O)OCc1ccccc1)NC(=O)CCc1c[nH]c2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 1/20 0.64
NMBR P28336 4/20 0.60
SIRT5 Q9NXA8 1/20 0.58
PTGER4 P35408 3/20 0.58
SIRT2 Q8IXJ6 1/20 0.55
SIRT1 Q96EB6 1/20 0.55
SIRT3 Q9NTG7 1/20 0.55
CA2 P00918 1/20 0.52
MMP9 P14780 1/20 0.52
MMP8 P22894 1/20 0.52
KISS1R Q969F8 3/20 0.52
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
HTT P42858 1/20 0.49
FOLH1 Q04609 1/20 0.49

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
SCHEMBL5655249 0.93 BMP1 (0.61) BMP1NMBRSIRT5PTGER4SIRT2
SCHEMBL5654676 0.93 BMP1 (0.62) BMP1NMBRSIRT5PTGER4SIRT2
SCHEMBL28759869 0.86 PTGER4 (0.62) BMP1NMBRSIRT5PTGER4SIRT2
SCHEMBL5652289 0.86 PTGER4 (0.62) BMP1NMBRSIRT5PTGER4SIRT2
SCHEMBL5652870 0.86 BMP1 (0.60) BMP1NMBRSIRT5PTGER4SIRT2
SCHEMBL12672467 0.84 BMP1 (0.87) BMP1NMBRCA2MMP9MMP8
SCHEMBL8363810 0.80 BMP1 (0.62) BMP1SIRT5MMP9MMP8KISS1R
SCHEMBL8242676 0.80 SIRT5 (0.65) BMP1NMBRSIRT5MMP9MMP8
SCHEMBL7135014 0.80 MMP1 (0.63) BMP1NMBR
SCHEMBL7135018 0.80 MMP1 (0.63) BMP1NMBR

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-20070142638-A1 Ornithine derivatives as prostaglandin e2 agonists or antagonists ASTELLAS PHARMA INC. (JP) 2007-06-21 US disclosed
EP-1697337-A2 ORNITHINE DERIVATIVES AS PROSTAGLANDIN-E2-AGONISTS OR ANTAGONISTS Astellas Pharma Inc. (JP) 2006-09-06 EP disclosed
WO-2005061475-A2 ORNITHINE DERIVATIVES AS PROSTAGLANDIN E2 AGONISTS OR ANTAGONISTS ASTELLAS PHARMA INC. (JP) 2005-07-07 WO 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-20070142638-A1 Ornithine derivatives as prostaglandin e2 agonists or antagonists PTGER4, OXER1, RXFP4 BMP1 2769/4885NMBR 846/4885SIRT5 1504/4885

“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.