SCHEMBL4392569

SCHEMBL4392569

C=CCOC[C@H]1O[C@H](OCC)[C@H](OCC=C)[C@@H](OCC=C)[C@H]1OCC=C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.35
▸ SSTR1 P30872 1/20 0.30
▸ SSTR2 P30874 1/20 0.30
▸ SSTR4 P31391 1/20 0.30
▸ SSTR3 P32745 1/20 0.30
▸ SSTR5 P35346 1/20 0.30

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
SCHEMBL6225008 1.00 ALDH1A1 (0.35) ALDH1A1SSTR1SSTR2SSTR4SSTR3
SCHEMBL13893879 1.00 ALDH1A1 (0.35) ALDH1A1SSTR1SSTR2SSTR4SSTR3
SCHEMBL27109199 0.95 ALDH1A1 (0.34) ALDH1A1
SCHEMBL7769373 0.91 ALDH1A1 (0.39) ALDH1A1
SCHEMBL7769371 0.91 ALDH1A1 (0.39) ALDH1A1
SCHEMBL3437762 0.91 ALDH1A1 (0.39) ALDH1A1
SCHEMBL3437761 0.88 SSTR1 (0.30) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL16457180 0.86 SSTR1 (0.40) ALDH1A1SSTR1SSTR2SSTR4SSTR3
SCHEMBL14342163 0.86 SSTR1 (0.40) ALDH1A1SSTR1SSTR2SSTR4SSTR3
SCHEMBL1033398 0.86 SSTR1 (0.40) ALDH1A1SSTR1SSTR2SSTR4SSTR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524821-B2 Scaffolded maleimide clusters for multivalent peptide assembly UNIVERSITY OF MARYLAND BIOTECHNOLOGY INSTITUTE (US) 2009-04-28 — — US disclosed
US-20050159341-A1 Scaffolded maleimide clusters for multivalent peptide assembly UNIVERSITY OF MARYLAND BIOTECHNOLOGY INSTITUTE 2005-07-21 — — US disclosed
EP-1532159-A2 SCAFFOLDED MALEIMIDE CLUSTERS FOR MULTIVALENT PEPTIDE ASSEMBLY University of Maryland Biotechnology Institute (US) 2005-05-25 — — EP disclosed
WO-2004000802-A2 SCAFFOLDED MALEIMIDE CLUSTERS FOR MULTIVALENT PEPTIDE ASSEMBLY UNIVERSITY OF MARYLAND BIOTECHNOLOGY INSTITUTE (US) 2003-12-31 — — WO disclosed
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