SCHEMBL21587198

SCHEMBL21587198

C1=Cc2c(sc3cc(-c4c5c(c(-c6cc(-c7ccccc7)cc(-c7ccccc7)c6)c6ccccc46)CCC=C5)ccc23)CC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 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
SCHEMBL21687015 0.84 ALDH1A1 (0.35) LIMK1
SCHEMBL24884848 0.83 LIMK1 (0.41) LIMK1
SCHEMBL22293524 0.78 PIM3 (0.35) LIMK1
SCHEMBL21587161 0.77 ALDH1A1 (0.33) —
SCHEMBL12436002 0.76 CHRNB2 (0.33) —
SCHEMBL23719569 0.76 ALOX5 (0.40) —
SCHEMBL13083514 0.76 ALDH1A1 (0.34) —
SCHEMBL23472983 0.75 ALOX5 (0.30) —
SCHEMBL24027515 0.75 ACHE (0.36) —
SCHEMBL20146401 0.75 ESR1 (0.32) LIMK1

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-3579292-A1 ORGANIC LIGHT EMITTING DEVICE LG Chem, Ltd. (KR) 2019-12-11 — — EP disclosed
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