SCHEMBL10408744

SCHEMBL10408744

OC[C@H]1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 1/20 0.53
▸ PDE4D Q08499 1/20 0.52
▸ NT5E P21589 1/20 0.52
▸ PTPN1 P18031 6/20 0.49
▸ CDC25B P30305 6/20 0.49
▸ TACR2 P21452 3/20 0.49
▸ SLC6A2 P23975 1/20 0.48
▸ SSTR1 P30872 1/20 0.48
▸ SSTR2 P30874 1/20 0.48
▸ SSTR4 P31391 1/20 0.48
▸ SSTR3 P32745 1/20 0.48
▸ SSTR5 P35346 1/20 0.48
▸ PTPN2 P17706 2/20 0.47
▸ PTPN6 P29350 2/20 0.47
▸ PTPN11 Q06124 2/20 0.47
▸ BCHE P06276 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ GJB2 P29033 1/20 0.46

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
SCHEMBL10408745 1.00 HTR1A (0.53) HTR1APDE4DNT5EPTPN1CDC25B
SCHEMBL21657199 0.98 HTR1A (0.52) HTR1APDE4DNT5EPTPN1CDC25B
SCHEMBL28943950 0.98 HTR1A (0.52) HTR1APDE4DNT5EPTPN1CDC25B
SCHEMBL8723384 0.98 HTR1A (0.52) HTR1APDE4DNT5EPTPN1CDC25B
SCHEMBL25031771 0.93 GJB2 (0.53) HTR1APDE4DNT5EPTPN1CDC25B
SCHEMBL10408203 0.92 PDE4D (0.51) HTR1APDE4DNT5ETACR2SLC6A2
SCHEMBL10408205 0.92 PDE4D (0.51) HTR1APDE4DNT5ETACR2SLC6A2
SCHEMBL21013403 0.91 SLC6A2 (0.53) HTR1APDE4DNT5EPTPN1CDC25B
SCHEMBL16229070 0.90 PDE4D (0.50) HTR1APDE4DNT5EPTPN1CDC25B
SCHEMBL13164466 0.90 PDE4D (0.50) HTR1APDE4DNT5EPTPN1CDC25B

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
US-4968790-A HYPOGLYCEMIC AGENTS, PLANT GROWTH REGULATORS AMERICAN CYANAMID COMPANY (US) 1990-11-06 — — US disclosed
EP-0354323-A2 Antidiabetic phosphates AMERICAN CYANAMID COMPANY (US) 1990-02-14 — — EP disclosed
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