SCHEMBL21716879

SCHEMBL21716879

c1ccc(-n2c3ccccc3c3cc(-c4nc5ccccc5nc4-n4c5ccccc5c5cc6c(-n7c8ccccc8c8c9ccccc9ccc87)cccc6cc54)ccc32)cc1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 0.34
PTGES O14684 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PTGER4 P35408 1/20 0.32

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
SCHEMBL21716210 0.94 KDM4E (0.38) GSRKDM4EATML3MBTL1PTGER4
SCHEMBL21717083 0.92 GSR (0.40) GSRKDM4EATML3MBTL1PTGER4
SCHEMBL21716461 0.92 GSR (0.36) GSRPTGESKDM4E
SCHEMBL21716239 0.92 PTGES (0.34) GSRPTGESKDM4EATML3MBTL1
SCHEMBL21717068 0.91 GSR (0.34) GSRPTGESKDM4EATML3MBTL1
SCHEMBL21213125 0.89 KDM4E (0.37) GSRPTGESKDM4EATML3MBTL1
SCHEMBL21213246 0.89 KDM4E (0.37) GSRPTGESKDM4EATML3MBTL1
SCHEMBL23471765 0.89 KDM4E (0.36) GSRPTGESKDM4EATML3MBTL1
SCHEMBL23471767 0.89 KDM4E (0.36) GSRPTGESKDM4EATML3MBTL1
SCHEMBL21213194 0.89 KDM4E (0.36) GSRPTGESKDM4EATML3MBTL1

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-11192884-B2 Heterocyclic compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2021-12-07 US disclosed
US-20200048226-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2020-02-13 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-11192884-B2 Heterocyclic compound and organic light-emitting device comprising same CYP1A1, CYP1B1, CRY1 GSR 3951/4885PTGES 1203/4885KDM4E 1813/4885
US-20200048226-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CYP1A1, CYP1B1, CRY1 GSR 3951/4885PTGES 1203/4885KDM4E 1813/4885

“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.