SCHEMBL30719637

SCHEMBL30719637

Cc1cc(C)cc(-c2n[nH]c(=O)c3ccccc23)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.66
NPSR1 Q6W5P4 1/20 0.66
LMNA P02545 2/20 0.61
TSHR P16473 1/20 0.61
KDM4E B2RXH2 3/20 0.58
ALDH1A1 P00352 3/20 0.58
MAPT P10636 2/20 0.58
POLB P06746 1/20 0.58
GAA P10253 1/20 0.58
ALOX15 P16050 1/20 0.58
HSD17B10 Q99714 1/20 0.58
PDE4A P27815 1/20 0.57
PDE4B Q07343 1/20 0.57
PDE4C Q08493 1/20 0.57
PDE4D Q08499 1/20 0.57
MAPK1 P28482 2/20 0.52
NCOA1 Q15788 1/20 0.52
NCOA3 Q9Y6Q9 1/20 0.52
HPGD P15428 2/20 0.51
KMT2A Q03164 2/20 0.50

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
SCHEMBL4722654 1.00 ATM (0.66) ATMNPSR1LMNATSHRKDM4E
SCHEMBL1786578 0.84 ATM (0.73) ATMNPSR1LMNATSHRKDM4E
SCHEMBL29818828 0.83 LMNA (0.58) ATMNPSR1LMNATSHRKDM4E
SCHEMBL6963334 0.83 LMNA (0.58) ATMNPSR1LMNATSHRKDM4E
SCHEMBL14124140 0.82 LMNA (0.61) ATMNPSR1LMNATSHRKDM4E
Hydrochloric Acid SCHEMBL29818605 0.81 LMNA (0.56) ATMNPSR1LMNATSHRKDM4E
SCHEMBL23496959 0.80 PDE4A (0.62) ATMNPSR1LMNATSHRKDM4E
SCHEMBL30719646 0.80 PDE4A (0.62) ATMNPSR1LMNATSHRKDM4E
SCHEMBL581143 0.80 NPSR1 (1.00) ATMNPSR1LMNATSHRKDM4E
SCHEMBL29870198 0.80 NPSR1 (1.00) ATMNPSR1LMNATSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117586191-A TOLL-like receptor 8 (TLR 8) specific antagonists, methods of making and uses thereof 科罗拉多州立大学董事会法人团体 2024-02-23 CN disclosed
CN-117586108-A TOLL-like receptor 8 (TLR 8) specific antagonists, methods of making and uses thereof 科罗拉多州立大学董事会法人团体 2024-02-23 CN disclosed
CN-111542515-B TOLL-like receptor 8 (TLR 8) specific antagonists, methods of making and uses thereof 科罗拉多州立大学董事会法人团体 2023-12-05 CN disclosed