SCHEMBL21671241

SCHEMBL21671241

N#Cc1ccc(-c2ccc3ccccc3c2)cc1-c1ccc2c3c(cccc13)-c1c-2c(-c2ccccc2)c2ccccc2c1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.44
FASN P49327 1/20 0.41
PDE9A O76083 1/20 0.38
MCL1 Q07820 1/20 0.37
XDH P47989 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
PGGT1B P53609 1/20 0.34
SLC22A12 Q96S37 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
SCHEMBL21671251 0.93 PIM1 (0.41) PIM1FASNPDE9AMCL1XDH
SCHEMBL21671470 0.92 PIM1 (0.45) PIM1FASNPDE9AMCL1XDH
SCHEMBL21671475 0.92 MAOA (0.37) FASNMCL1XDHMAOAMAOB
SCHEMBL21671240 0.89 MCL1 (0.45) PIM1MCL1XDHMAOAMAOB
SCHEMBL21671250 0.89 MCL1 (0.45) PIM1MCL1XDHMAOAMAOB
SCHEMBL21671242 0.89 MAOA (0.37) PIM1FASNPDE9AMCL1XDH
SCHEMBL21671243 0.88 MAOA (0.35) FASNMCL1XDHMAOAMAOB
SCHEMBL30170138 0.87 MCL1 (0.43) PIM1FASNPDE9AMCL1XDH
SCHEMBL21643664 0.87 MCL1 (0.43) PIM1FASNPDE9AMCL1XDH
SCHEMBL13170710 0.87 MCL1 (0.39) PIM1FASNMCL1CYP11B1CYP11B2

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-11696495-B2 Organic emitting compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2023-07-04 US disclosed
US-20200044157-A1 Organic Emitting Compound, and Organic Light Emitting Diode and Organic Light Emitting Display Device Including the Same LG DISPLAY CO., LTD. (KR) 2020-02-06 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-11696495-B2 Organic emitting compound, and organic light emitting diode and organic light emitting display device including the same OCIAD1, ALDH1A2, OCIAD2 PIM1 781/4885FASN 4210/4885PDE9A 3380/4885
US-20200044157-A1 Organic Emitting Compound, and Organic Light Emitting Diode and Organic Light Emitting Display Device Including the Same OCIAD1, ALDH1A2, OCIAD2 PIM1 781/4885FASN 4210/4885PDE9A 3380/4885

“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.