SCHEMBL21965149

SCHEMBL21965149

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5-c5nc(-c6ccccc6)nc(-c6cccc(-n7c8ccccc8c8ccccc87)c6)n5)ccc43)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PDE10A Q9Y233 1/20 0.35
PTGER4 P35408 1/20 0.35
NPY5R Q15761 1/20 0.33
ALDH1A1 P00352 2/20 0.33
TSPO P30536 1/20 0.32
ABCG2 Q9UNQ0 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
GAA P10253 1/20 0.32
POLB P06746 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
ADORA2A P29274 2/20 0.32
ADORA3 P0DMS8 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
ADORA2B P29275 1/20 0.32
ADORA1 P30542 1/20 0.32

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
SCHEMBL22010677 0.99 KDM4E (0.40) KDM4EATML3MBTL1PDE10APTGER4
SCHEMBL22672103 0.96 ATM (0.40) KDM4EATML3MBTL1PDE10APTGER4
SCHEMBL21965261 0.95 KDM4E (0.38) KDM4EATML3MBTL1PDE10APTGER4
SCHEMBL24152003 0.94 KDM4E (0.45) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL17897514 0.94 KDM4E (0.45) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL22672134 0.93 KDM4E (0.37) KDM4EATML3MBTL1PDE10APTGER4
SCHEMBL22010233 0.93 ALDH1A1 (0.35) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL22596528 0.92 KDM4E (0.38) KDM4EATML3MBTL1PDE10AALDH1A1
SCHEMBL22596084 0.92 KDM4E (0.38) KDM4EATML3MBTL1PDE10APTGER4
SCHEMBL27262891 0.92 TSPO (0.36) KDM4EATML3MBTL1PTGER4NPY5R

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-20200144512-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2020-05-07 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-20200144512-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES GDA, SOD1, GALC KDM4E 3566/4885ATM 1867/4885L3MBTL1 615/4885

“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.