SCHEMBL21717068

SCHEMBL21717068

c1ccc(-n2c3ccccc3c3cc(-c4nc5ccccc5nc4-n4c5ccccc5c5cc6c(-n7c8ccccc8c8ccc9ccccc9c87)cccc6cc54)ccc32)cc1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 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
TDP1 Q9NUW8 1/20 0.31
PTGES O14684 1/20 0.30

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
SCHEMBL21717122 0.92 GSR (0.37) GSRTDP1
SCHEMBL21716210 0.92 KDM4E (0.38) GSRKDM4EATML3MBTL1PTGER4
SCHEMBL21716285 0.92 KDM4E (0.34) GSRKDM4EATML3MBTL1PTGER4
SCHEMBL21716879 0.91 GSR (0.34) GSRKDM4EATML3MBTL1PTGER4
SCHEMBL21717083 0.91 GSR (0.40) GSRKDM4EATML3MBTL1PTGER4
SCHEMBL21716483 0.88 KDM4E (0.34) KDM4EATML3MBTL1PTGER4PTGES
SCHEMBL21716786 0.87 GSR (0.39) GSRTDP1
SCHEMBL21717412 0.87 ABCG2 (0.36) KDM4EATML3MBTL1PTGER4
SCHEMBL22425572 0.87 KDM4E (0.35) KDM4EATML3MBTL1PTGER4PTGES
SCHEMBL21717020 0.87 GSR (0.34) GSRKDM4EATML3MBTL1TDP1

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 3951/4885KDM4E 1813/4885ATM 3428/4885
US-20200048226-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CYP1A1, CYP1B1, CRY1 GSR 3951/4885KDM4E 1813/4885ATM 3428/4885

“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.