SCHEMBL28697678

SCHEMBL28697678

[c]1cccc2[nH]c3ccc4c(c3c12)Cc1ccccc1-4

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.41
CA2 P00918 6/20 0.41
CA4 P22748 6/20 0.41
CA6 P23280 6/20 0.41
PNMT P11086 1/20 0.35
PGR P06401 1/20 0.33
NTRK1 P04629 2/20 0.33
KDR P35968 2/20 0.33
MAP3K9 P80192 2/20 0.33
MAP3K10 Q02779 2/20 0.33
MAP3K11 Q16584 2/20 0.33
PRKD3 O94806 1/20 0.33
PRKCG P05129 1/20 0.33
PRKCB P05771 1/20 0.33
PRKCA P17252 1/20 0.33
PRKCH P24723 1/20 0.33
PRKCI P41743 1/20 0.33
PRKCE Q02156 1/20 0.33
PRKCQ Q04759 1/20 0.33
PRKCZ Q05513 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
SCHEMBL28701351 0.81 MAPK8 (0.35) CA1CA2CA4CA6NTRK1
SCHEMBL22653001 0.78 CA1 (0.58) CA1CA2CA4CA6NTRK1
SCHEMBL29985899 0.78 CA1 (0.58) CA1CA2CA4CA6NTRK1
SCHEMBL815115 0.75 PNMT (0.37) CA1CA2CA4CA6PNMT
SCHEMBL814655 0.73 PNMT (0.40) CA1CA2CA4CA6PNMT
SCHEMBL18729347 0.72 CA1 (0.38) CA1CA2CA4CA6PGR
SCHEMBL28604204 0.69 CA1 (0.58) CA1CA2CA4CA6PNMT
SCHEMBL285402 0.67 CA1 (0.40) CA1CA2CA4CA6PNMT
SCHEMBL22263591 0.67 PNMT (0.57) CA1CA2CA4CA6PNMT
SCHEMBL2388664 0.67 ALDH1A1 (0.39) KDM4EALDH1A1LMNAMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115768766-A Compound and organic light-emitting element including the same LT素材株式会社 2023-03-07 CN disclosed
CN-115697983-A Heterocyclic compound and organic light-emitting element including same LT素材株式会社 2023-02-03 CN disclosed
CN-114761409-A Heterocyclic compound and organic light-emitting element comprising same LT素材株式会社 2022-07-15 CN disclosed
CN-114746423-A Heterocyclic compound and organic light-emitting element including same LT素材株式会社 2022-07-12 CN disclosed
CN-114080387-A Compound and organic light emitting device including the same LT素材株式会社 2022-02-22 CN disclosed