SCHEMBL21378065

SCHEMBL21378065

N#Cc1c(-n2c3ccccc3c3ccccc32)c(-n2c3ccccc3c3ccccc32)c(-c2ccccc2-n2c3cnccc3c3ccncc32)c(-n2c3ccccc3c3ccccc32)c1-n1c2ccccc2c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.38
IDO1 P14902 1/20 0.37
PDE10A Q9Y233 6/20 0.33
MAOA P21397 4/20 0.32
MAOB P27338 4/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32
ACHE P22303 1/20 0.32
PIP4K2A P48426 1/20 0.31
CDK5 Q00535 1/20 0.31
DYRK1A Q13627 1/20 0.31
CDK5R1 Q15078 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL21377930 1.00 CYP11B2 (0.38) CYP11B2IDO1PDE10AMAOAMAOB
SCHEMBL21378080 0.90 CYP11B2 (0.36) CYP11B2IDO1PDE10APIP4K2A
SCHEMBL21378034 0.90 CYP11B2 (0.36) CYP11B2IDO1PDE10APIP4K2A
SCHEMBL21378008 0.89 CYP11B2 (0.33) CYP11B2IDO1
SCHEMBL30322689 0.89 ALDH1A1 (0.37) CYP11B2HTR2AHTR2CALDH1A1
SCHEMBL21377928 0.89 ALDH1A1 (0.37) CYP11B2HTR2AHTR2CALDH1A1
SCHEMBL16127461 0.85 CYP11B2 (0.46) CYP11B2IDO1MAOAMAOBNCOA3
SCHEMBL21378081 0.84 IDO1 (0.35) CYP11B2IDO1PIP4K2A
SCHEMBL21378018 0.83 CYP11B2 (0.36) CYP11B2PDE10AMAOAMAOBACHE
SCHEMBL21378045 0.83 CYP11B2 (0.36) CYP11B2PDE10AMAOAMAOBACHE

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 CYP11B2 1221/4885IDO1 1569/4885PDE10A 3833/4885
US-11608333-B2 Composition of matter for use in organic light-emitting diodes CRY2, SLCO1B3, NDUFV3 CYP11B2 1221/4885IDO1 1569/4885PDE10A 3833/4885

“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.