SCHEMBL21244079

SCHEMBL21244079

CON(C)CC(OC1CCC(C(=O)O)CC1)(C(=O)Cc1ccc2nc(Nc3cc(F)ccc3C)oc2c1F)N1CCCC1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 20/20 0.64
ITGA4 P13612 20/20 0.64

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
SCHEMBL29455085 1.00 ITGB1 (0.64) ITGB1ITGA4
SCHEMBL2429793 0.91 ITGB1 (0.64) ITGB1ITGA4
SCHEMBL2430815 0.87 ITGB1 (0.63) ITGB1ITGA4
SCHEMBL2433073 0.87 ITGB1 (0.63) ITGB1ITGA4
SCHEMBL2433070 0.87 ITGB1 (0.63) ITGB1ITGA4
SCHEMBL2433286 0.86 ITGB1 (0.57) ITGB1ITGA4
SCHEMBL2433714 0.85 ITGB1 (0.62) ITGB1ITGA4
SCHEMBL2437953 0.82 ITGB1 (0.57) ITGB1ITGA4
SCHEMBL2434779 0.82 ITGB1 (0.57) ITGB1ITGA4
SCHEMBL2434776 0.82 ITGB1 (0.57) ITGB1ITGA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12419619-B2 Aspiration device YALE UNIVERSITY (US) 2025-09-23 US disclosed
EP-4360567-A2 ASPIRATION DEVICE Yale University (US) 2024-05-01 EP disclosed
EP-3528709-B1 ASPIRATION DEVICE UNIV YALE (US) 2023-12-06 EP disclosed
US-20220211645-A1 Maximizing Distribution and Minimizing Washout of Injectates in Bone and Method for Enhanced Aspirate Extraction YALE UNIVERSITY 2022-07-07 US disclosed
US-20190247027-A1 ASPIRATION DEVICE YALE UNIVERSITY 2019-08-15 US disclosed