SCHEMBL23453246

SCHEMBL23453246

O=C(NCC(NC(=O)c1ccc2oc(C3=Cc4ccc(NCCCS(=O)(=O)O)cc4OC3O)nc2c1)C(=O)O)C1=C/C=C\C=C/C=C\1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 1/20 0.35
▸ ITGA2B P08514 1/20 0.35
▸ ITGB1 P05556 1/20 0.31
▸ ITGA4 P13612 1/20 0.31
▸ ITGB7 P26010 1/20 0.31

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
SCHEMBL23419434 0.82 ITGB3 (0.37) ITGB3ITGA2BITGB1ITGA4ITGB7
SCHEMBL25997471 0.73 ITGB3 (0.37) ITGB3ITGA2B
SCHEMBL23419323 0.68 MAPT (0.44) ITGB3ITGA2B
SCHEMBL22371415 0.63 HSPD1 (0.40) —
SCHEMBL31135859 0.63 HSPD1 (0.40) —
SCHEMBL25997464 0.58 ITGB3 (0.39) ITGB3ITGA2B
SCHEMBL1675382 0.57 MAPT (0.52) —
SCHEMBL1675386 0.56 MAPT (0.51) —
SCHEMBL25438806 0.55 SMN1; SMN2 (0.35) —
SCHEMBL23419617 0.55 ITGAV (0.33) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12031178-B2 Cyclooctatetraene containing dyes and compositions ILLUMINA CAMBRIDGE LIMITED (GB) 2024-07-09 — — US disclosed
US-20230265502-A1 CYCLOOCTATETRAENE CONTAINING DYES AND COMPOSITIONS ILLUMINA CAMBRIDGE LIMITED (GB) 2023-08-24 — — US disclosed
WO-2021104845-A1 CYCLOOCTATETRAENE CONTAINING DYES AND COMPOSITIONS ILLUMINA CAMBRIDGE LIMITED (GB) 2021-06-03 — — WO disclosed
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