SCHEMBL30098352

SCHEMBL30098352

CC(C)C[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC1=O

nearest known ligand 0.76

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.76
ITGAV P06756 15/20 0.76
ITGB5 P18084 8/20 0.73
ITGA2B P08514 5/20 0.71
ITGA5 P08648 3/20 0.67
ITGB1 P05556 1/20 0.65

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
SCHEMBL31294830 0.93 ITGB3 (0.80) ITGB3ITGAVITGB5ITGA2BITGA5
Cyclorgdfv SCHEMBL30636069 0.91 ITGB3 (0.78) ITGB3ITGAVITGB5ITGA2BITGA5
Cyclorgdfv SCHEMBL29384091 0.91 ITGB3 (0.78) ITGB3ITGAVITGB5ITGA2BITGA5
SCHEMBL29464836 0.90 ITGB3 (0.75) ITGB3ITGAVITGB5ITGA2BITGA5
SCHEMBL29578997 0.90 ITGB3 (0.75) ITGB3ITGAVITGB5ITGA2BITGA5
SCHEMBL29366713 0.89 ITGB3 (0.74) ITGB3ITGAVITGB5ITGA2BITGA5
SCHEMBL17364341 0.89 ITGB3 (0.74) ITGB3ITGAVITGB5ITGA2BITGA5
Cilengitide SCHEMBL34082 0.86 ITGB3 (0.78) ITGB3ITGAVITGB5ITGA2BITGA5
Cilengitide SCHEMBL19534260 0.86 ITGB3 (0.78) ITGB3ITGAVITGB5ITGA2BITGA5
Cilengitide SCHEMBL26970603 0.86 ITGB3 (0.78) ITGB3ITGAVITGB5ITGA2BITGA5

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-20230024434-A1 Methods for Developing Personalized Drug Treatment Plans and Targeted Drug Development Based on Proteomic Profiles SOMALOGIC, INC. (US) 2023-01-26 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-20230024434-A1 Methods for Developing Personalized Drug Treatment Plans and Targeted Drug Development Based on Proteomic Profiles TTR, TPX2, FABP1 ITGB3 2444/4885ITGAV 1301/4885ITGB5 1288/4885

“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.