SCHEMBL21736006

SCHEMBL21736006

c1ccc(-n2c3ccccc3c3c(-c4nc(-n5c6ccccc6c6cc7ccccc7cc65)c5oc6ccccc6c5n4)cccc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.38
MAPT P10636 6/20 0.36
KDM4E B2RXH2 4/20 0.36
HRH4 Q9H3N8 4/20 0.36
HSD17B10 Q99714 4/20 0.36
LMNA P02545 3/20 0.36
MAPK1 P28482 2/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 3/20 0.36
TP53 P04637 2/20 0.34
HTT P42858 2/20 0.34
HCRTR1 O43613 1/20 0.34
HPGD P15428 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
ATM Q13315 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
NPY1R P25929 1/20 0.33
NPY2R P49146 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
SCHEMBL21736481 0.89 TSHR (0.39) TSHRMAPTKDM4EHRH4HSD17B10
SCHEMBL20669838 0.87 TSHR (0.40) TSHRMAPTKDM4EHRH4HSD17B10
SCHEMBL21736368 0.87 PIK3CD (0.31) TSHRMAPTKDM4EHSD17B10MAPK1
SCHEMBL21736483 0.86 TSHR (0.40) TSHRMAPTKDM4EHRH4HSD17B10
SCHEMBL20669938 0.86 TSHR (0.41) TSHRMAPTKDM4EHRH4HSD17B10
SCHEMBL21736376 0.86 SMN1; SMN2 (0.37) KDM4EHSD17B10LMNAMAPK1MEN1
SCHEMBL21736023 0.85 TSHR (0.44) TSHRMAPTKDM4EHRH4HSD17B10
SCHEMBL21736454 0.85 TSHR (0.44) TSHRMAPTKDM4EHRH4HSD17B10
SCHEMBL21474789 0.84 MAPT (0.37) TSHRMAPTKDM4EHSD17B10LMNA
SCHEMBL21736440 0.83 TSHR (0.42) TSHRMAPTKDM4EHRH4HSD17B10

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-11530225-B2 Compound and organic light-emitting diode comprising same LG CHEM, LTD. (KR) 2022-12-20 US disclosed
US-20200055865-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2020-02-20 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-11530225-B2 Compound and organic light-emitting diode comprising same CRY1, CRY2, TRPA1 TSHR 4719/4885MAPT 1009/4885KDM4E 1417/4885
US-20200055865-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME CRY1, CRY2, TRPA1 TSHR 4719/4885MAPT 1009/4885KDM4E 1417/4885

“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.