SCHEMBL21165714

SCHEMBL21165714

c1ccc(-c2cccc(-n3c4ccc(-c5ccc(-c6ccc7c(c6)c6c(-c8ccccc8)cccc6n7-c6ccccc6)cc5)cc4c4c(-c5ccccc5)cccc43)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 1/20 0.43
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39
ALDH1A1 P00352 2/20 0.36
HTT P42858 2/20 0.36
FAAH O00519 1/20 0.36
HSP90AA1 P07900 1/20 0.36
PKM P14618 1/20 0.36
MGLL Q99685 1/20 0.36
PDE10A Q9Y233 1/20 0.36
MAPK14 Q16539 1/20 0.35
HTR1A P08908 1/20 0.35
HTR7 P34969 1/20 0.35
KMT2A Q03164 2/20 0.35
IL1R1 P14778 1/20 0.35
TSPO P30536 1/20 0.34
HDAC4 P56524 1/20 0.34
ALK Q9UM73 2/20 0.34

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
SCHEMBL19997820 1.00 ATM (0.43) ATML3MBTL1KDM4EJAK2JAK3
SCHEMBL19997816 0.99 ATM (0.42) ATML3MBTL1KDM4EJAK2JAK3
SCHEMBL21165630 0.99 ATM (0.42) ATML3MBTL1KDM4EJAK2JAK3
SCHEMBL14900730 0.99 ATM (0.42) ATML3MBTL1KDM4EJAK2JAK3
SCHEMBL21165631 0.99 ATM (0.41) ATML3MBTL1KDM4EJAK2JAK3
SCHEMBL19997834 0.99 ATM (0.41) ATML3MBTL1KDM4EJAK2JAK3
SCHEMBL21666168 0.97 L3MBTL1 (0.46) ATML3MBTL1KDM4EJAK2JAK3
SCHEMBL19997807 0.96 L3MBTL1 (0.47) ATML3MBTL1KDM4EJAK2JAK3
SCHEMBL19997814 0.96 L3MBTL1 (0.47) ATML3MBTL1KDM4EJAK2JAK3
SCHEMBL21165642 0.96 ATM (0.40) ATML3MBTL1KDM4EJAK2JAK3

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-20190221750-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-07-18 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-20190221750-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE CONDENSED CYCLIC COMPOUND CRY1, CRY2, MCM4 ATM 1310/4885L3MBTL1 2041/4885KDM4E 3296/4885

“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.