SCHEMBL7565262

SCHEMBL7565262

COC(=O)CCCCCCCCO[C@H]1O[C@H](C)[C@@H](O)[C@H](OC(C)=O)[C@H]1O[C@H]1O[C@H](COC(C)=O)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ SSTR1 P30872 1/20 0.42
▸ SSTR2 P30874 1/20 0.42
▸ SSTR4 P31391 1/20 0.42
▸ SSTR3 P32745 1/20 0.42
▸ SSTR5 P35346 1/20 0.42
▸ TACR1 P25103 3/20 0.41
▸ SELP P16109 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ PAX8 Q06710 1/20 0.39
▸ CYP2D6 P10635 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ TSHR P16473 1/20 0.37
▸ PTPN1 P18031 1/20 0.37
▸ TNF P01375 1/20 0.36

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
SCHEMBL7565269 0.94 LMNA (0.43) LMNAKMT2ASSTR1SSTR2SSTR4
SCHEMBL7566509 0.93 LGALS8 (0.45) LMNAKMT2ASSTR1SSTR2SSTR4
SCHEMBL7566502 0.93 LGALS8 (0.45) LMNAKMT2ASSTR1SSTR2SSTR4
SCHEMBL7571406 0.92 TACR1 (0.42) LMNAKMT2ASSTR1SSTR2SSTR4
SCHEMBL7572772 0.91 TACR1 (0.41) LMNAKMT2ASSTR1SSTR2SSTR4
SCHEMBL7572776 0.90 LMNA (0.40) LMNAKMT2ASSTR1SSTR2SSTR4
SCHEMBL7572781 0.90 LMNA (0.40) LMNAKMT2ASSTR1SSTR2SSTR4
SCHEMBL7571414 0.90 LMNA (0.40) LMNAKMT2ASSTR1SSTR2SSTR4
SCHEMBL7571410 0.90 LMNA (0.40) LMNAKMT2ASSTR1SSTR2SSTR4
SCHEMBL7563588 0.89 SELP (0.42) LMNAKMT2ASSTR1SSTR2SSTR4

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
EP-0830365-B1 MODIFIED KOJIBIOSIDES ANALOGUES ALBERTA RES COUNCIL (CA) 2002-09-04 — — EP disclosed
US-5877157-A Modified kojibioside analogues ALBERTA RESEARCH COUNCIL (CA) 1999-03-02 — — US disclosed
US-5633233-A Modified kojibiosides analogues ALBERTA RESEARCH COUNCIL (CA) 1997-05-27 — — US disclosed
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