SCHEMBL30189883

SCHEMBL30189883

CCc1cnc2c(B3OC(C)(C)C(C)(C)O3)cc(Cl)cc2c1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.35
PARP1 P09874 1/20 0.33
LIPE Q05469 1/20 0.31
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
HIF1A Q16665 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
SCHEMBL19782702 1.00 UCHL1 (0.35) UCHL1PARP1LIPELPLLIPG
SCHEMBL19776254 0.83 UCHL1 (0.34) UCHL1LIPE
SCHEMBL29481814 0.83 UCHL1 (0.34) UCHL1LIPE
SCHEMBL29481822 0.80 UCHL1 (0.35) UCHL1LIPE
SCHEMBL19776055 0.80 UCHL1 (0.35) UCHL1LIPE
SCHEMBL30189867 0.79 EGFR (0.35) LIPE
SCHEMBL19783805 0.79 EGFR (0.35) LIPE
SCHEMBL21395408 0.77 BACE1 (0.33) LIPE
SCHEMBL30189937 0.77 BACE1 (0.33) LIPE
SCHEMBL19776338 0.76 CTSD (0.34) LIPE

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
CN-109689647-B Bicyclic heteroaryl substituted compounds 百时美施贵宝公司 2023-01-20 CN disclosed