SCHEMBL19899461

SCHEMBL19899461

Cc1cc(CO)ccc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 10/20 0.40
LPL P06858 9/20 0.40
F11 P03951 2/20 0.39
UCHL1 P09936 1/20 0.35
ESR2 Q92731 2/20 0.33
HSD17B10 Q99714 1/20 0.32
ESR1 P03372 1/20 0.32
S1PR4 O95977 1/20 0.32
F2 P00734 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
CNR1 P21554 1/20 0.30
CNR2 P34972 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
SCHEMBL15000455 0.87 LIPG (0.40) LIPGLPLF11UCHL1ESR2
SCHEMBL13531863 0.84 LIPG (0.43) LIPGLPLF11UCHL1ESR2
SCHEMBL18353771 0.82 LIPG (0.53) LIPGLPLF11UCHL1ESR2
SCHEMBL30577723 0.82 F11 (0.41) LIPGLPLF11UCHL1ESR2
SCHEMBL2699203 0.82 LIPG (0.39) LIPGLPLF11UCHL1ESR2
SCHEMBL14707184 0.82 LIPG (0.39) LIPGLPLF11UCHL1ESR2
SCHEMBL5265730 0.81 GAA (0.40) LIPGLPLUCHL1HSD17B10
SCHEMBL22589556 0.81 LPL (0.38) LIPGLPLF11UCHL1ESR2
SCHEMBL19675305 0.81 LIPG (0.38) LIPGLPLF11UCHL1ESR2
SCHEMBL29421509 0.81 LPL (0.38) LIPGLPLF11UCHL1ESR2

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
WO-2024233665-A1 COMPOUNDS AND THEIR USE AGAINST CANCER TANGO THERAPEUTICS, INC. (US) 2024-11-14 WO disclosed
WO-2018037120-A1 PRODRUGS ACTIVATED BY REACTIVE OXYGEN SPECIES FOR USE IN THE TREATMENT OF INFLAMMATORY DISEASES AND CANCER DANMARKS TEKNISKE UNIVERSITET (DK) 2018-03-01 WO disclosed
WO-2018037120-A1 PRODRUGS ACTIVATED BY REACTIVE OXYGEN SPECIES FOR USE IN THE TREATMENT OF INFLAMMATORY DISEASES AND CANCER DANMARKS TEKNISKE UNIVERSITET (DK) 2018-03-01 WO disclosed