SCHEMBL23754647

SCHEMBL23754647

CC(C)(C)C(COCCOCCOCCI)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33

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
SCHEMBL22770977 0.84 NOS3 (0.33) NOS3NOS1NOS2
SCHEMBL1134009 0.84 NOS3 (0.33) NOS3NOS1NOS2
SCHEMBL4734335 0.84 MEN1 (0.41) NOS3NOS1NOS2
SCHEMBL17841798 0.84 NOS3 (0.33) NOS3NOS1NOS2
SCHEMBL18059962 0.84 MEN1 (0.41) NOS3NOS1NOS2
SCHEMBL22588782 0.79 HSD17B10 (0.43) NOS3NOS1NOS2
SCHEMBL25289772 0.79 TSHR (0.35) NOS3NOS1NOS2
SCHEMBL15020184 0.79
SCHEMBL23042730 0.76 NOS3 (0.35) NOS3NOS1NOS2
SCHEMBL7626489 0.75 TSHR (0.31)

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
WO-2021162493-A1 PROTEIN KINASE DEGRADATION INDUCING COMPOUND, AND USE THEREOF 보로노이 주식회사 2021-08-19 WO disclosed