SCHEMBL5879666

SCHEMBL5879666

O=C(O)CC1c2ccccc2C(=O)N(CCCCc2ccc(NC(=O)NCc3ccccc3)cc2)c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 18/20 1.00
ITGAV P06756 18/20 1.00
NAMPT P43490 1/20 0.44
CDC25A P30304 1/20 0.43

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
SCHEMBL5879843 0.86 ITGB3 (1.00) ITGB3ITGAV
SCHEMBL5879543 0.86 ITGB3 (0.76) ITGB3ITGAVNAMPT
SCHEMBL5879684 0.84 ITGB3 (0.73) ITGB3ITGAVCDC25A
SCHEMBL5879746 0.79 ITGB3 (0.65) ITGB3ITGAVCDC25A
SCHEMBL5879552 0.78 ITGB3 (0.83) ITGB3ITGAV
SCHEMBL5880224 0.76 ITGB3 (1.00) ITGB3ITGAV
SCHEMBL5879531 0.73 ITGB3 (0.75) ITGB3ITGAVNAMPT
SCHEMBL5879584 0.71 ITGB3 (0.73) ITGB3ITGAV
SCHEMBL5879698 0.70 ITGB3 (0.71) ITGB3ITGAVNAMPT
SCHEMBL5879561 0.69 ITGB3 (0.70) ITGB3ITGAV

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-7105508-B1 Integrin receptors antagonists ABBOTT GMBH & CO. KG (DE) 2006-09-12 US disclosed