SCHEMBL7032372

SCHEMBL7032372

Cc1ccccc1NC(=O)N[C@@H](CNC(=O)c1ccc(OCCNc2ncccn2)cc1O)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 5/20 0.41
ITGA5 P08648 5/20 0.41
ITGB3 P05106 4/20 0.41
ITGAV P06756 4/20 0.41
PYGL P06737 1/20 0.41
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
ANPEP P15144 1/20 0.37
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GAA P10253 1/20 0.36
MCHR1 Q99705 1/20 0.36

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
SCHEMBL7036478 0.91 POLB (0.39) ITGB1ITGA5ITGB3ITGAVMEN1
SCHEMBL7030523 0.91 ALDH1A1 (0.43) MEN1KMT2APOLBKDM4EADRB2
SCHEMBL7037756 0.90 KDM4E (0.38) ITGB1ITGA5ITGB3ITGAVMEN1
SCHEMBL7034173 0.90 ITGB1 (0.39) ITGB1ITGA5ITGB3ITGAVMEN1
SCHEMBL7032164 0.90 ITGB1 (0.44) ITGB1ITGA5ITGB3ITGAVPYGL
SCHEMBL7032406 0.89 ITGB1 (0.42) ITGB1ITGA5ITGB3ITGAVMEN1
SCHEMBL7036058 0.89 MEN1 (0.44) ITGB1ITGA5ITGB3ITGAVMEN1
SCHEMBL7031208 0.88 POLB (0.43) ITGB1ITGA5ITGB3ITGAVMEN1
SCHEMBL7038269 0.86 PYGL (0.41) ITGB3ITGAVPYGLMEN1KMT2A
SCHEMBL7030532 0.86 FPR2 (0.46) ITGB1ITGA5MEN1KMT2APOLB

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 2 patents. 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
US-20030186967-A1 Acylresorcinol derivatives are selective vitronectin receptor inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 2003-10-02 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-20030186967-A1 Acylresorcinol derivatives are selective vitronectin receptor inhibitors ASGR1, TEK, APLNR ITGB1 306/4885ITGA5 450/4885ITGB3 403/4885

“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.