SCHEMBL21716718

SCHEMBL21716718

c1ccc(-n2c3ccccc3c3c(-c4nc5ccccc5nc4-c4cccc(-n5c6ccccc6c6c(-n7c8ccccc8c8cc9ccccc9cc87)c7ccccc7cc65)c4)cccc32)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 2/20 0.33
ATM Q13315 1/20 0.33
CYP1A2 P05177 1/20 0.32
PDE10A Q9Y233 1/20 0.32
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 1/20 0.30
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL21716844 0.96 L3MBTL1 (0.36) L3MBTL1KDM4EATMCYP1A2PDE10A
SCHEMBL21716245 0.91 CYP1A2 (0.32) L3MBTL1KDM4EATMCYP1A2PDE10A
SCHEMBL21716256 0.89 KDM4E (0.35) L3MBTL1KDM4EATMCYP1A2
SCHEMBL21717664 0.88 KDM4E (0.32) L3MBTL1KDM4EATMCYP1A2PDE10A
SCHEMBL21717599 0.85
SCHEMBL21716887 0.84 KDM4E (0.38) L3MBTL1KDM4EATMCYP1A2
SCHEMBL21716868 0.84 GSR (0.33) L3MBTL1KDM4EATMCYP1A2
SCHEMBL21717626 0.84 GSR (0.33) L3MBTL1KDM4EATMCYP1A2
SCHEMBL21716380 0.83 AURKA (0.33) L3MBTL1KDM4EATM
SCHEMBL21716972 0.83 CYP1A2 (0.31) CYP1A2

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 L3MBTL1 1427/4885KDM4E 1813/4885ATM 3428/4885
US-20200048226-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CYP1A1, CYP1B1, CRY1 L3MBTL1 1427/4885KDM4E 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.