SCHEMBL21728239

SCHEMBL21728239

CC(C)(c1ccc(C2=CCCc3cccnc32)cc1)c1ccc(-c2cc(-c3ccccc3)nc(C3=CCCC=C3)n2)cc1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 1/20 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
SCHEMBL21728208 0.95 TOP1 (0.32) TOP1
SCHEMBL21728129 0.83
SCHEMBL21728224 0.83
SCHEMBL21728331 0.81 MEN1 (0.33)
SCHEMBL21728515 0.80 MEN1 (0.41)
SCHEMBL21728198 0.78
SCHEMBL21728475 0.77 TDP1 (0.34) TOP1
SCHEMBL21728325 0.75 MEN1 (0.40)
SCHEMBL21728240 0.75 ADORA1 (0.32)
SCHEMBL21728329 0.74 MEN1 (0.40)

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-3214084-B1 CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEMICAL LTD (KR) 2020-02-19 EP disclosed