SCHEMBL19977871

SCHEMBL19977871

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc6c(cc54)C4(c5ccccc5O6)c5ccccc5N(c5ccccc5)c5ccccc54)c3)n2)cc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADAMTS5 Q9UNA0 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL19977852 0.96 KDM4E (0.30) KDM4EATML3MBTL1
SCHEMBL19977863 0.94 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL19977846 0.93
SCHEMBL19977639 0.92
SCHEMBL19977833 0.90 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL23184470 0.90 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL19977824 0.89
SCHEMBL19977638 0.88
SCHEMBL23184467 0.88 KDM4E (0.31) KDM4EATML3MBTL1
SCHEMBL19979690 0.88

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11081650-B2 Spiro compound and organic light-emitting element comprising same LG CHEM, LTD. 2021-08-03 US disclosed
US-20180083198-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-22 US disclosed
US-20180083198-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-22 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-11081650-B2 Spiro compound and organic light-emitting element comprising same RER1, NR2E3, RIF1 ADAMTS5 4729/4885KDM4E 2668/4885ATM 978/4885
US-20180083198-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME NR2E3, CRY1, ERG ADAMTS5 4198/4885KDM4E 2931/4885ATM 951/4885

“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.