SCHEMBL24488501

SCHEMBL24488501

C1=Cc2c(n(-c3ccc(-c4ccc(N(c5ccccc5)c5ccc(-c6cccc7ccccc67)cc5)cc4)cc3)c3ccccc23)CC1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA9 Q16790 1/20 0.32

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
SCHEMBL27266614 0.91 CA12 (0.34) CA12CA1CA2CA9
SCHEMBL19311765 0.91 KDM4E (0.34) —
SCHEMBL26220159 0.89 — —
SCHEMBL20714496 0.88 KDM4E (0.39) —
SCHEMBL17384138 0.88 L3MBTL1 (0.34) —
SCHEMBL24972152 0.88 CA12 (0.32) CA12CA1CA2CA9
SCHEMBL24679666 0.88 ALK (0.31) CA12CA1CA2CA9
SCHEMBL24971551 0.88 — —
SCHEMBL23659487 0.87 MCL1 (0.31) —
SCHEMBL23784481 0.86 KDM4E (0.39) —

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-3741827-B1 ORGANIC LIGHT EMITTING DIODE LG CHEMICAL LTD (KR) 2022-06-08 — — EP disclosed
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