SCHEMBL10138534

SCHEMBL10138534

CCCC(=O)NCCCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC1=O

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 10/20 0.60
ITGAV P06756 6/20 0.60
ITGB1 P05556 1/20 0.60
ITGA5 P08648 1/20 0.60
MC4R P32245 10/20 0.56
MC5R P33032 10/20 0.56
MC3R P41968 10/20 0.56
MC1R Q01726 10/20 0.56
ITGB5 P18084 3/20 0.56
ITGA2B P08514 4/20 0.51

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
SCHEMBL15397366 1.00 ITGB3 (0.60) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL12462935 0.94 ITGB3 (0.53) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL24253307 0.94 ITGB3 (0.57) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL19605457 0.94 ITGB3 (0.57) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL24285406 0.92 ITGB3 (0.60) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL10259650 0.92 MC4R (0.62) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL24253223 0.92 ITGB3 (0.58) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL24253222 0.92 ITGB3 (0.58) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL12146076 0.91 ITGB3 (0.50) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL21766911 0.91 ITGB3 (0.58) ITGB3ITGAVITGB1ITGA5MC4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120046735-A1 PLASMA MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES, INCORPORATED (US) 2012-02-23 US disclosed
US-20120046735-A1 PLASMA MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES, INCORPORATED (US) 2012-02-23 US disclosed
US-20120046757-A1 COVALENT MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES (US) 2012-02-23 US disclosed
WO-2008006097-A2 COVALENT MODIFICATION OF METAL SURFACES INTEZYNE TECHNOLOGIES LLC (US) 2008-01-10 WO disclosed
US-7179446-B2 Simultaneous imaging of cardiac perfusion and a vitronectin receptor targeted imaging agent BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-02-20 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 (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-20120046757-A1 COVALENT MODIFICATION OF METAL SURFACES ITGAL, ITGA1, ITGA5 ITGB3 12/4885ITGAV 24/4885ITGB1 15/4885

“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.