Diasesartemin

Diasesartemin

SCHEMBL17385609

COc1cc([C@H]2OC[C@H]3[C@@H]2CO[C@H]3c2cc(OC)c3c(c2)OCO3)cc(OC)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 1.00
▸ PTPN1 P18031 3/20 0.71
▸ MAPK1 P28482 2/20 0.61
▸ MAPK3 P27361 1/20 0.61
▸ PPARD Q03181 5/20 0.59
▸ PPARG P37231 4/20 0.59
▸ PPARA Q07869 1/20 0.57
▸ CYP3A4 P08684 3/20 0.50
▸ ALOX5 P09917 1/20 0.48
▸ MAPT P10636 2/20 0.48
▸ TRPM8 Q7Z2W7 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ MCL1 Q07820 1/20 0.48

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
Diasesartemin SCHEMBL17385619 1.00 ACHE (1.00) ACHEPTPN1MAPK1MAPK3PPARD
Diasesartemin SCHEMBL17385611 1.00 ACHE (1.00) ACHEPTPN1MAPK1MAPK3PPARD
Diasesartemin SCHEMBL17399779 1.00 ACHE (1.00) ACHEPTPN1MAPK1MAPK3PPARD
Diasesartemin SCHEMBL17385610 1.00 ACHE (1.00) ACHEPTPN1MAPK1MAPK3PPARD
Diasesartemin SCHEMBL17385613 1.00 ACHE (1.00) ACHEPTPN1MAPK1MAPK3PPARD
Diasesartemin SCHEMBL17385614 1.00 ACHE (1.00) ACHEPTPN1MAPK1MAPK3PPARD
Diasesartemin SCHEMBL17385615 1.00 ACHE (1.00) ACHEPTPN1MAPK1MAPK3PPARD
SCHEMBL30637504 0.95 ACHE (0.90) ACHEPTPN1MAPK1MAPK3PPARD
SCHEMBL17385612 0.87 ACHE (0.77) ACHEPTPN1MAPK1MAPK3PPARD
SCHEMBL17385616 0.87 ACHE (0.77) ACHEPTPN1MAPK1MAPK3PPARD

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-2962679-A1 Use of tetrahydrofuranlignans Symrise AG (DE) 2016-01-06 — — EP disclosed
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