SCHEMBL7121593

SCHEMBL7121593

O=C(O)CN1CCC(CC(=O)N2CCC3(CC2)CCN(c2ccncc2)C3)CC1

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.74
ITGA2B P08514 20/20 0.74

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
SCHEMBL7010717 0.86 ITGB3 (0.58) ITGB3ITGA2B
SCHEMBL7782706 0.86 ITGB3 (0.59) ITGB3ITGA2B
SCHEMBL7019568 0.83 ITGB3 (0.73) ITGB3ITGA2B
SCHEMBL7013014 0.83 ITGB3 (1.00) ITGB3ITGA2B
SCHEMBL7006823 0.82 ITGB3 (1.00) ITGB3ITGA2B
SCHEMBL7008270 0.81 ITGB3 (0.78) ITGB3ITGA2B
SCHEMBL484916 0.75 ITGB3 (0.68) ITGB3ITGA2B
SCHEMBL7013026 0.75 ITGB3 (1.00) ITGB3ITGA2B
SCHEMBL7790309 0.75 ITGB3 (0.57) ITGB3ITGA2B
SCHEMBL7393626 0.74 ITGB3 (0.57) ITGB3ITGA2B

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-20030055244-A1 Pyridyl-containing spirocyclic compounds as inhibitors of fibrinogen-dependent platelet aggregation MILLENNIUM PHARMACEUTICALS, INC. 2003-03-20 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-20030055244-A1 Pyridyl-containing spirocyclic compounds as inhibitors of fibrinogen-dependent platelet aggregation PF4, PFKP, FGB ITGB3 139/4885ITGA2B 90/4885

“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.