SCHEMBL6579893

SCHEMBL6579893

Nc1ccccc1Cn1nnnc1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.41
ERCC5 P28715 1/20 0.38
FEN1 P39748 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
ADORA3 P0DMS8 1/20 0.37
ADORA2A P29274 1/20 0.37
ADORA2B P29275 1/20 0.37
ADORA1 P30542 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TSHR P16473 2/20 0.36
LMNA P02545 1/20 0.36
RAB9A P51151 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
P2RX7 Q99572 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
HSD11B1 P28845 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
FDPS P14324 1/20 0.36

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
SCHEMBL10959104 0.81 ALDH1A1 (0.47) HPGDALDH1A1TSHRLMNARAB9A
SCHEMBL6581880 0.81 POLB (0.43) HPGDALDH1A1TSHRNPSR1HSD11B1
SCHEMBL6582004 0.81 POLB (0.40) HPGDALDH1A1TSHRNPSR1HSD11B1
SCHEMBL6577327 0.80 HPGD (0.54) HPGDERCC5FEN1HDAC6ALDH1A1
SCHEMBL11271744 0.78 HPGD (0.53) HPGDERCC5FEN1HDAC6ALDH1A1
SCHEMBL6580247 0.78 CYP1A2 (0.46) HPGDFEN1ADORA3ADORA2AADORA2B
SCHEMBL6580285 0.71 POLB (0.58) HPGDALDH1A1TSHRLMNARAB9A
SCHEMBL11069413 0.69 ALDH1A1 (0.52) HPGDERCC5FEN1HDAC6ALDH1A1
SCHEMBL16550566 0.67 ALDH1A1 (0.57) HPGDERCC5FEN1HDAC6ALDH1A1
Potassium Ion SCHEMBL11074604 0.67 ALDH1A1 (0.50) HPGDERCC5FEN1HDAC6ALDH1A1

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