SCHEMBL22893787

SCHEMBL22893787

c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4c6ccccc6ccc4n5-c4nc(-c5cc6ccccc6c6c5oc5ccccc56)c5ccccc5n4)ccc32)cc1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.32
SIRT1 Q96EB6 1/20 0.32
PTGES O14684 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PTGER4 P35408 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
SCHEMBL22893788 0.96 KDM4E (0.34) SIRT2SIRT1PTGESKDM4EATM
SCHEMBL22894035 0.91 TDP1 (0.31) SIRT2SIRT1L3MBTL1
SCHEMBL22893997 0.90 SIRT2 (0.33) SIRT2SIRT1PTGESKDM4EATM
SCHEMBL22893974 0.90 KDM4E (0.31) KDM4EL3MBTL1
SCHEMBL22893736 0.89 KDM4E (0.33) SIRT2SIRT1KDM4EATML3MBTL1
SCHEMBL22893738 0.88 KDM4E (0.35) SIRT2SIRT1KDM4EATML3MBTL1
SCHEMBL22894036 0.88
SCHEMBL22893827 0.88 SIRT2 (0.32) SIRT2SIRT1PTGESKDM4EATM
SCHEMBL22893881 0.88 SIRT2 (0.32) SIRT2SIRT1PTGESKDM4EATM
SCHEMBL22893789 0.87 KDM4E (0.31) KDM4EATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210013411-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LT MATERIALS CO., LTD. (KR) 2021-01-14 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 (1 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-20210013411-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, CYP1A1, CYP1B1 SIRT2 1235/4885SIRT1 923/4885PTGES 763/4885

“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.