SCHEMBL19789024

SCHEMBL19789024

CN/C(=N\C(=N/CC/C=C\C=C(C)C)c1ccccc1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.31
CACNA1B Q00975 1/20 0.31
APBA1 Q02410 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
SCHEMBL19040657 0.75 GLA (0.40) GLACACNA1BAPBA1
SCHEMBL16977092 0.68 GLA (0.41) GLACACNA1BAPBA1
SCHEMBL20821007 0.68 GLA (0.39) GLACACNA1BAPBA1
SCHEMBL22134608 0.67 GLA (0.41) GLACACNA1BAPBA1
SCHEMBL20612832 0.67 GLA (0.41) GLACACNA1BAPBA1
SCHEMBL21986014 0.65 GLA (0.41) GLACACNA1BAPBA1
SCHEMBL20083134 0.65 KMT2A (0.43) GLACACNA1BAPBA1
SCHEMBL24084001 0.63 KMT2A (0.31)
SCHEMBL18868797 0.63 GLA (0.35) GLACACNA1BAPBA1
SCHEMBL16642047 0.63 GLA (0.42) GLACACNA1BAPBA1

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-2725080-B1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME LG CHEMICAL LTD (KR) 2018-01-24 EP disclosed