SCHEMBL22487530

SCHEMBL22487530

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccc(-c6ccc7sc8ccccc8c7c6)cc5c5c6c7ccccc7n(-c7ccccc7)c6ccc54)c4sc5ccccc5c34)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.30

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
SCHEMBL22486570 0.95 KDM4E (0.32) LIMK1
SCHEMBL22487529 0.94
SCHEMBL22486628 0.93 KDM4E (0.32) LIMK1
SCHEMBL22487517 0.92 KDM4E (0.32)
SCHEMBL22486584 0.92 KDM4E (0.35)
SCHEMBL22486624 0.90 KDM4E (0.34)
SCHEMBL22486569 0.89 KDM4E (0.31) LIMK1
SCHEMBL22486608 0.89
SCHEMBL22487568 0.88 KDM4E (0.34) LIMK1
SCHEMBL22486578 0.88

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-2020197253-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 2020-10-01 WO disclosed