SCHEMBL28610775

SCHEMBL28610775

CCCCC(C)(C)C(C)(C)c1cccnn1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.34
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL29107363 0.94 FAAH (0.38) FAAHTDP1L3MBTL1
SCHEMBL21191587 0.80 FAAH (0.37) FAAHTDP1L3MBTL1
SCHEMBL22624088 0.80 FAAH (0.34) FAAHTDP1L3MBTL1
SCHEMBL21478368 0.79 FAAH (0.39) FAAHTDP1L3MBTL1
SCHEMBL21191684 0.78 CNR2 (0.41) FAAHTDP1L3MBTL1
SCHEMBL21909378 0.77 CNR2 (0.43) FAAHTDP1L3MBTL1
SCHEMBL21039533 0.77 CNR2 (0.43) FAAHTDP1L3MBTL1
SCHEMBL2512666 0.77 CNR2 (0.43) FAAHTDP1L3MBTL1
SCHEMBL21191736 0.77 FAAH (0.40) FAAHTDP1L3MBTL1
SCHEMBL21124081 0.77 FAAH (0.40) FAAHTDP1L3MBTL1

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-113083257-A Preparation method and application of multiple-interlocking functional organic polymer material 南开大学 2021-07-09 CN claimed