SCHEMBL7036686

SCHEMBL7036686

CCOC(=O)[C@H](CNC(=O)c1ccc(OCCNc2ncccn2)cc1O)NC(=O)OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 10/20 0.43
ITGAV P06756 3/20 0.43
MAPT P10636 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ITGA2B P08514 7/20 0.42
EGLN2 Q96KS0 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
CTSS P25774 7/20 0.41
CTSK P43235 6/20 0.41
CTSL P07711 2/20 0.41

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
Hydrochloric Acid SCHEMBL7036683 0.99 ITGB3 (0.43) ITGB3ITGAVMAPTL3MBTL1ITGA2B
Hydrochloric Acid SCHEMBL7030628 0.99 ITGB3 (0.43) ITGB3ITGAVMAPTL3MBTL1ITGA2B
SCHEMBL7037152 0.94 ITGB3 (0.44) ITGB3ITGAVMAPTL3MBTL1ITGA2B
SCHEMBL7037156 0.94 ITGB3 (0.44) ITGB3ITGAVMAPTL3MBTL1ITGA2B
SCHEMBL7035290 0.92 ITGB3 (0.51) ITGB3ITGAVITGA2BEGLN2EGLN1
SCHEMBL7037876 0.92 ITGB3 (0.51) ITGB3ITGAVITGA2BEGLN2EGLN1
SCHEMBL7032427 0.89 ITGB3 (0.41) ITGB3ITGAVITGA2BEGLN2EGLN1
SCHEMBL7035747 0.86 ITGB3 (0.50) ITGB3ITGAVITGA2B
Hydrochloric Acid SCHEMBL7038415 0.85 ITGB3 (0.49) ITGB3ITGAVITGA2B
Hydrochloric Acid SCHEMBL7035743 0.85 ITGB3 (0.49) ITGB3ITGAVITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030186967-A1 Acylresorcinol derivatives are selective vitronectin receptor inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 2003-10-02 US claimed

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-20030186967-A1 Acylresorcinol derivatives are selective vitronectin receptor inhibitors ASGR1, TEK, APLNR ITGB3 403/4885ITGAV 289/4885MAPT 4566/4885

“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.