SCHEMBL20159964

SCHEMBL20159964

c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5cccc6sc7ccc(-c8ccc9c(c8)c8cc%10ccccc%10cc8n9-c8cccc(-c9ccccc9)c8)cc7c56)ccc43)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PDE10A Q9Y233 1/20 0.32
S1PR4 O95977 2/20 0.31
S1PR5 Q9H228 2/20 0.31
TSPO P30536 1/20 0.31
ALK Q9UM73 2/20 0.30
ALOX5 P09917 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
SCHEMBL24765784 0.95 KDM4E (0.37) PIM3KDM4EATML3MBTL1PDE10A
SCHEMBL22671815 0.91 ATM (0.39) PIM3KDM4EATML3MBTL1PDE10A
SCHEMBL27253335 0.90 KDM4E (0.36) PIM3KDM4EATML3MBTL1PDE10A
SCHEMBL17660918 0.90 ATM (0.41) PIM3KDM4EATML3MBTL1PDE10A
SCHEMBL18779548 0.90 ATM (0.41) PIM3KDM4EATML3MBTL1PDE10A
SCHEMBL20159961 0.89 KDM4E (0.34) PIM3KDM4EATML3MBTL1PDE10A
SCHEMBL24765783 0.89 KDM4E (0.38) KDM4EATML3MBTL1S1PR4S1PR5
SCHEMBL22672199 0.89 L3MBTL1 (0.40) PIM3KDM4EATML3MBTL1PDE10A
SCHEMBL16545694 0.88 L3MBTL1 (0.42) PIM3KDM4EATML3MBTL1PDE10A
SCHEMBL22672323 0.88 PMM2 (0.34) KDM4EATML3MBTL1S1PR4S1PR5

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-11345687-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2022-05-31 US disclosed
WO-2018087022-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-05-17 WO 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-11345687-B2 Materials for organic electroluminescent devices DDT, TUFM, MT-ND5 PIM3 454/4885KDM4E 2161/4885ATM 4182/4885

“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.