SCHEMBL6580324

SCHEMBL6580324

CCOCn1nnnc1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.42
HCAR3 P49019 1/20 0.36
NPC1 O15118 1/20 0.35
MAPK14 Q16539 1/20 0.33
HSD17B10 Q99714 1/20 0.32
HTT P42858 1/20 0.32
ERCC5 P28715 1/20 0.32
FEN1 P39748 1/20 0.32
KDM4C Q9H3R0 1/20 0.31
ALDH1A1 P00352 2/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL6579797 0.82 MAPK1 (0.38) MAPK1HCAR3NPC1HSD17B10ERCC5
SCHEMBL6948864 0.80 NPC1 (0.48) MAPK1HCAR3NPC1ALDH1A1MEN1
SCHEMBL8921457 0.78 MAPK1 (0.53) MAPK1NPC1HSD17B10ALDH1A1LMNA
SCHEMBL9111798 0.75 HCAR3 (0.46) HCAR3HTT
SCHEMBL8925425 0.73 GHSR (0.41) MAPK1HSD17B10ERCC5FEN1MEN1
SCHEMBL4142949 0.72 ALDH1A1 (0.47) MAPK1NPC1HSD17B10KDM4CALDH1A1
Trifluoroacetic Acid SCHEMBL9386542 0.71 NPC1 (0.45) MAPK1HCAR3NPC1ALDH1A1MEN1
SCHEMBL22975616 0.70 MAPK1 (0.41) MAPK1ALDH1A1LMNA
SCHEMBL20128067 0.70 MAPK1 (0.33) MAPK1NPC1ALDH1A1
SCHEMBL6582834 0.70 MAPK1 (0.44) MAPK1NPC1HSD17B10ALDH1A1LMNA

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
EP-0716088-B1 PROCESS FOR PRODUCING 2-(TETRAZOL-5-YL)-4-OXO-4H-BENZOPYRANS SUMITOMO CHEMICAL CO (JP) 2004-02-18 EP disclosed
US-5597929-A Production process of 2-(tetrazol-5-yl)-4-oxo-4H-benzopyran SUMITOMO CHEMICAL CO., LTD. (JP) 1997-01-28 US disclosed
EP-0716088-A1 PROCESS FOR PRODUCING 2-(TETRAZOL-5-YL)-4-OXO-4H-BENZOPYRANS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-12 EP disclosed