SCHEMBL19683215

SCHEMBL19683215

CCCCCC(=O)NC(Cc1ccc(OC(=O)CN2CCCC2)cc1)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 5/20 0.49
▸ ITGA2B P08514 5/20 0.49
▸ PTPN1 P18031 2/20 0.44
▸ ACE P12821 3/20 0.42
▸ ACE2 Q9BYF1 3/20 0.42
▸ UGCG Q16739 2/20 0.42
▸ GRIA1 P42261 1/20 0.41
▸ FAAH O00519 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.39

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
SCHEMBL19683213 0.92 ITGB3 (0.48) ITGB3ITGA2BPTPN1ACEACE2
SCHEMBL19682976 0.92 ITGB3 (0.47) ITGB3ITGA2BPTPN1UGCG
SCHEMBL23974107 0.84 ITGB3 (0.58) ITGB3ITGA2BPTPN1GRIA1FAAH
SCHEMBL19683175 0.84 ITGB3 (0.58) ITGB3ITGA2BPTPN1GRIA1FAAH
SCHEMBL23974228 0.83 ITGB3 (0.53) ITGB3ITGA2BPTPN1GRIA1FAAH
SCHEMBL19683214 0.81 GRIA1 (0.46) ITGB3ITGA2BGRIA1
SCHEMBL19683236 0.80 ITGB1 (0.52) ITGB3ITGA2BPTPN1ACEACE2
SCHEMBL23974227 0.80 ITGB3 (0.59) ITGB3ITGA2BPTPN1ALDH1A1
SCHEMBL24276096 0.80 ITGB3 (0.59) ITGB3ITGA2BPTPN1ALDH1A1
SCHEMBL23425701 0.79 CTSD (0.37) ITGB3ITGA2BPTPN1ACEACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3464336-B1 COMPOUNDS ATHIRA PHARMA INC (US) 2022-03-16 — — EP disclosed
WO-2017210489-A1 COMPOUNDS M3 BIOTECHNOLOGY, INC. (US) 2017-12-07 — — WO disclosed
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