SCHEMBL22649248

SCHEMBL22649248

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c4c4ccccc4c4cc6ccccc6n45)c3)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PLA2G10 O15496 5/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
ABCG2 Q9UNQ0 4/20 0.32
TSHR P16473 1/20 0.32
PDE10A Q9Y233 1/20 0.32
MAPT P10636 1/20 0.31
PDE5A O76074 1/20 0.31

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
SCHEMBL16067191 0.96 KDM4E (0.36) KDM4EATML3MBTL1PLA2G10KMT2A
SCHEMBL16067212 0.94 KDM4E (0.34) KDM4EATML3MBTL1PLA2G10KMT2A
SCHEMBL16067132 0.92 PDE10A (0.34) KDM4EATML3MBTL1PLA2G10KMT2A
SCHEMBL16067174 0.89 KMT2A (0.36) KDM4EATML3MBTL1PLA2G10KMT2A
SCHEMBL22649070 0.88 ATM (0.33) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL16067215 0.87 KDM4E (0.34) KDM4EATML3MBTL1PLA2G10KMT2A
SCHEMBL19652297 0.87 L3MBTL1 (0.44) KDM4EATML3MBTL1PLA2G10KMT2A
SCHEMBL17033601 0.87 KDM4E (0.36) KDM4EATML3MBTL1PLA2G10KMT2A
SCHEMBL16067205 0.86 ATM (0.39) KDM4EATML3MBTL1PLA2G10KMT2A
SCHEMBL16066772 0.86 KDM4E (0.33) KDM4EATML3MBTL1PLA2G10KMT2A

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-20200358005-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-11-12 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-20200358005-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES PIEZO1, L1CAM, EFNA1 KDM4E 2430/4885ATM 3991/4885L3MBTL1 2124/4885

“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.