SCHEMBL18933880

SCHEMBL18933880

CC1(C)c2ccccc2-c2ccc(C/N=C(\N)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 16/20 0.46
▸ GRIN1 Q05586 4/20 0.46
▸ PDK2 Q15119 3/20 0.39

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
SCHEMBL25073716 0.80 GRIN2B (0.43) GRIN2BGRIN1PDK2
SCHEMBL25054534 0.77 PDK2 (0.38) PDK2
SCHEMBL17433189 0.75 GRIN1 (0.36) GRIN2BGRIN1PDK2
SCHEMBL22440859 0.75 PDK2 (0.61) PDK2
SCHEMBL17345727 0.75 PRSS1 (0.44) PDK2
SCHEMBL30951744 0.75 PDK2 (0.61) PDK2
SCHEMBL20832118 0.73 PDK2 (0.33) PDK2
SCHEMBL21845641 0.73 PDK2 (0.33) PDK2
SCHEMBL20204500 0.72 PDK2 (0.36) PDK2
SCHEMBL20617212 0.72 PDK2 (0.34) PDK2

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-2017095156-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2017-06-08 — — WO disclosed
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