SCHEMBL4402283

SCHEMBL4402283

C1=Cc2c(cccc2-c2ccc3c(c2)c2cc(N(c4ccccc4)c4cccc(N(c5ccccc5)c5ccc6c(c5)c5cc(-c7cccc8ccccc78)ccc5n6-c5ccccc5)c4)ccc2n3-c2ccccc2)CC1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.31
ACMSD Q8TDX5 1/20 0.31
TLR4 O00206 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
SCHEMBL4406836 0.94 MCL1 (0.30) MCL1ACMSD
SCHEMBL4404193 0.92 MCL1 (0.31) MCL1ACMSD
SCHEMBL16066090 0.86 KDM4E (0.34)
SCHEMBL4400887 0.86 MCL1 (0.40) MCL1ACMSDTLR4
SCHEMBL26149360 0.85 ALK (0.32)
SCHEMBL24032437 0.85 ALK (0.33)
SCHEMBL4404931 0.84 MCL1 (0.40) MCL1ACMSDTLR4
SCHEMBL24678976 0.83
SCHEMBL4400212 0.82 MCL1 (0.41) MCL1ACMSDTLR4
SCHEMBL24679387 0.82 ALK (0.33)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178885-B2 Aromatic amine compound, and light emitting element, light emitting device, and electronic device using aromatic amine compound SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-05-15 US disclosed
US-20100308319-A1 AROMATIC AMINE COMPOUND, AND LIGHT EMITTING ELEMENT, LIGHT EMITTING DEVICE, AND ELECTRONIC DEVICE USING AROMATIC AMINE COMPOUND SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2010-12-09 US disclosed