SCHEMBL19581485

SCHEMBL19581485

CCC(NC(=N)N)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](CC(=O)O)NC(=O)CNC1=O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 18/20 0.51
▸ ITGAV P06756 14/20 0.51
▸ ITGA2B P08514 4/20 0.51
▸ CD2 P06729 1/20 0.49
▸ CD58 P19256 1/20 0.49
▸ ITGB5 P18084 8/20 0.49
▸ ITGA5 P08648 4/20 0.48
▸ ITGB1 P05556 2/20 0.48
▸ ITGB6 P18564 1/20 0.47
▸ ITGB8 P26012 1/20 0.47
▸ ST14 Q9Y5Y6 1/20 0.47

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
SCHEMBL2534763 0.89 ITGB3 (0.46) ITGB3ITGAVITGA2BCD2CD58
SCHEMBL16177739 0.86 ITGB3 (0.54) ITGB3ITGAVITGA2BITGB5ITGA5
SCHEMBL23802907 0.84 ITGB3 (0.46) ITGB3ITGAVITGA2BITGB5ITGA5
SCHEMBL13107808 0.84 ITGB3 (0.55) ITGB3ITGAVITGA2BITGB5ITGA5
SCHEMBL19605481 0.84 ITGB3 (0.55) ITGB3ITGAVITGA2BITGB5ITGA5
SCHEMBL12547669 0.84 ITGB3 (0.55) ITGB3ITGAVITGA2BITGB5ITGA5
SCHEMBL7743533 0.84 ITGB3 (0.55) ITGB3ITGAVITGA2BITGB5ITGA5
SCHEMBL14885799 0.84 ITGB3 (0.55) ITGB3ITGAVITGA2BITGB5ITGA5
SCHEMBL21475019 0.84 ITGB3 (0.55) ITGB3ITGAVITGA2BITGB5ITGA5
SCHEMBL12808284 0.84 ITGB3 (0.55) ITGB3ITGAVITGA2BITGB5ITGA5

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-20170325457-A1 FORMULATIONS FOR THE DELIVERY OF ACTIVE AGENTS TO INSECTS, PLANTS, AND PLANT PATHOGENS Preceres Inc. (US) 2017-11-16 — — 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-20170325457-A1 FORMULATIONS FOR THE DELIVERY OF ACTIVE AGENTS TO INSECTS, PLANTS, AND PLANT PATHOGENS NSF, GET3, SLC47A2 ITGB3 4569/4885ITGAV 3343/4885ITGA2B 4269/4885

“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.

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