SCHEMBL7080700

SCHEMBL7080700

CC(C)(C)OC(=O)c1ccnc(C(=O)O)c1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.42
ASPH Q12797 6/20 0.42
KDM8 Q8N371 6/20 0.42
ATR Q13535 1/20 0.40
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
BLM P54132 1/20 0.38
AGER Q15109 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GRM6 O15303 1/20 0.35
KDM5A P29375 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
LMNA P02545 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL28027039 0.88 KDM4E (0.42) KDM4EASPHKDM8ATRALDH1A1
SCHEMBL28485640 0.84 ATR (0.51) KDM4EATRALDH1A1MAPTL3MBTL1
SCHEMBL6261311 0.83 ATR (0.43) KDM4EATRALDH1A1GRM6CA12
SCHEMBL3243857 0.81 ATR (0.42) KDM4EATRALDH1A1MAPTALOX15
SCHEMBL6671123 0.80 ATR (0.53) KDM4EATRALDH1A1GRM6LMNA
SCHEMBL7080699 0.79 GRM6 (0.41) KDM4EASPHKDM8ATRALDH1A1
SCHEMBL22750385 0.79 ATR (0.40) KDM4EASPHKDM8ATRALDH1A1
SCHEMBL18159123 0.78 KDM4E (0.60) KDM4EASPHKDM8ALDH1A1MAPT
SCHEMBL16515769 0.78 KDM4E (0.61) KDM4EALDH1A1MAPTL3MBTL1CYP3A4
SCHEMBL6255617 0.76 ATR (0.37) ATRALDH1A1MAPTALOX15GRM6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4511375-A1 BICYCLIC COMPOUNDS Aligos Therapeutics, Inc. (US) 2025-02-26 EP disclosed
WO-2023205653-A1 BICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. (US) 2023-10-26 WO disclosed
EP-0758328-B1 ANTI-CANCER COMPOUNDS CONTAINING CYCLOPENTAQUINAZOLINE RING BTG INT LTD (GB) 2003-07-16 EP disclosed
EP-0667864-B1 TRICYCLIC COMPOUNDS WITH PHARMACEUTICAL ACTIVITY ZENECA LTD (GB) 1997-09-24 EP disclosed