SCHEMBL21378032

SCHEMBL21378032

Cc1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccccc2-n2c3ccccc3c3cnccc32)cc(-n2c3ccccc3c3cc(C)ccc32)c1C#N

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
CYP11B2 P19099 2/20 0.38
ELANE P08246 2/20 0.36
MAOA P21397 4/20 0.35
MAOB P27338 4/20 0.35
CYP2D6 P10635 1/20 0.34
PDE10A Q9Y233 7/20 0.34
IDO1 P14902 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
SCHEMBL21377994 1.00 ACHE (0.40) ACHEGRIN1GRIN2ACYP11B2ELANE
SCHEMBL21377979 1.00 ACHE (0.40) ACHEGRIN1GRIN2ACYP11B2ELANE
SCHEMBL21396826 0.89 CYP11B2 (0.38) ACHEGRIN1GRIN2ACYP11B2ELANE
SCHEMBL21396894 0.87 CYP11B2 (0.39) ACHEGRIN1GRIN2ACYP11B2ELANE
SCHEMBL19909047 0.85 CYP11B2 (0.38) ACHECYP11B2ELANE
SCHEMBL21378049 0.84 ACHE (0.39) ACHEGRIN1GRIN2ACYP11B2ELANE
SCHEMBL23912060 0.84 CYP11B2 (0.51) CYP11B2MAOAPDE10A
SCHEMBL19917611 0.82 GABRA1 (0.37) ACHE
SCHEMBL21377909 0.82 ELANE (0.39) ACHEGRIN1GRIN2ACYP11B2ELANE
SCHEMBL21396587 0.81 CYP11B2 (0.33) ACHEGRIN1GRIN2ACYP11B2

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-11608333-B2 Composition of matter for use in organic light-emitting diodes KYULUX, INC. (JP) 2023-03-21 US disclosed
US-20190292181-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES Kyulux North America, Inc. 2019-09-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190292181-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES CRY2, SLCO1B3, NDUFV3 ACHE 251/4885GRIN1 1201/4885GRIN2A 859/4885
US-11608333-B2 Composition of matter for use in organic light-emitting diodes CRY2, SLCO1B3, NDUFV3 ACHE 251/4885GRIN1 1201/4885GRIN2A 859/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.