SCHEMBL24276204

SCHEMBL24276204

CCCCCC(=O)NC(Cc1ccc(OP(O)O)cc1)C(N)=O

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 4/20 0.56
▸ ITGA2B P08514 4/20 0.56
▸ PTPN1 P18031 2/20 0.49
▸ GRIA1 P42261 1/20 0.46
▸ FAAH O00519 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.44
▸ ACACB O00763 1/20 0.44
▸ HDAC1 Q13547 2/20 0.44
▸ HDAC6 Q9UBN7 2/20 0.44
▸ PSMB5 P28074 2/20 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
SCHEMBL23974227 0.87 ITGB3 (0.59) ITGB3ITGA2BPTPN1ALDH1A1HDAC1
SCHEMBL24276096 0.87 ITGB3 (0.59) ITGB3ITGA2BPTPN1ALDH1A1HDAC1
SCHEMBL24916640 0.86 ITGB3 (0.48) ITGB3ITGA2BPTPN1GRIA1FAAH
SCHEMBL24916583 0.84 ACACB (0.61) ITGB3ITGA2BACACB
SCHEMBL19683175 0.83 ITGB3 (0.58) ITGB3ITGA2BPTPN1GRIA1FAAH
SCHEMBL23974107 0.83 ITGB3 (0.58) ITGB3ITGA2BPTPN1GRIA1FAAH
SCHEMBL9666396 0.81 FAAH (0.65) ITGB3ITGA2BPTPN1FAAHHDAC1
SCHEMBL23974228 0.81 ITGB3 (0.53) ITGB3ITGA2BPTPN1GRIA1FAAH
SCHEMBL24916613 0.80 PSMB5 (0.46) ITGB3ITGA2BPTPN1GRIA1FAAH
SCHEMBL9666189 0.80 FAAH (0.67) ITGB3ITGA2BPTPN1FAAHHDAC1

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
EP-3464336-B1 COMPOUNDS ATHIRA PHARMA INC (US) 2022-03-16 — — EP disclosed
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