SCHEMBL18934933

SCHEMBL18934933

c1ccc(C2=NC(c3cc(-c4ccc5cc(-c6nc7ccccc7c7ccncc67)ccc5c4)cc(-c4cccc5ccccc45)c3)NC(c3ccccc3)N2)cc1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TNF P01375 1/20 0.34
▸ CSNK2A2 P19784 10/20 0.33
▸ CSNK2B P67870 10/20 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
SCHEMBL18934716 0.94 TNF (0.36) TNFCSNK2A2CSNK2B
SCHEMBL18934732 0.93 TNF (0.38) TNFCSNK2A2CSNK2B
SCHEMBL18935154 0.87 CYP11B1 (0.36) TNFCSNK2A2CSNK2B
SCHEMBL18935294 0.85 CA12 (0.31) —
SCHEMBL18935395 0.85 CA12 (0.32) —
SCHEMBL18934931 0.84 CSNK2A2 (0.32) CSNK2A2CSNK2B
SCHEMBL18934734 0.84 CSNK2A2 (0.37) CSNK2A2CSNK2B
SCHEMBL18935160 0.83 — —
SCHEMBL18935157 0.83 CSNK2A2 (0.30) CSNK2A2CSNK2B
SCHEMBL18934726 0.82 CSNK2A2 (0.35) CSNK2A2CSNK2B

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-2017095100-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 2017-06-08 — — WO disclosed
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