SCHEMBL22640468

SCHEMBL22640468

C=C(C)CC1C=CNCC1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
GFER P55789 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL5315456 0.74 SLC6A12 (0.38)
SCHEMBL22814668 0.73
SCHEMBL14646693 0.69
SCHEMBL2482912 0.69 MEN1 (0.31) MEN1GAAMAPTALOX15CASP1
SCHEMBL10716927 0.69
SCHEMBL28068698 0.66
SCHEMBL17039195 0.65
SCHEMBL1506414 0.65 EPHX1 (0.34) ALOX15
SCHEMBL17039209 0.64
SCHEMBL22670233 0.63

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
EP-3244462-B1 ORGANIC ELECTROLUMINESCENT ELEMENT HODOGAYA CHEMICAL CO LTD (JP) 2020-11-11 EP disclosed