SCHEMBL6580167

SCHEMBL6580167

O=C(O)c1nnnn1Cc1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 1/20 0.45
FEN1 P39748 1/20 0.45
FLT1 P17948 1/20 0.45
KDR P35968 1/20 0.45
TDO2 P48775 2/20 0.43
MDM2 Q00987 2/20 0.43
HDAC6 Q9UBN7 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
TSHR P16473 2/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
RAB9A P51151 1/20 0.42
HTT P42858 2/20 0.41
HPGD P15428 1/20 0.41
IDO1 P14902 1/20 0.40
CYP19A1 P11511 1/20 0.40
HDAC1 Q13547 1/20 0.40
NOTUM Q6P988 1/20 0.40
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL6577327 0.87 HPGD (0.54) ERCC5FEN1HDAC6TSHRALDH1A1
SCHEMBL6580310 0.86 HDAC6 (0.45) ERCC5FEN1TDO2HDAC6TSHR
SCHEMBL11271744 0.85 HPGD (0.53) ERCC5FEN1HDAC6TSHRALDH1A1
SCHEMBL6582001 0.82 ERCC5 (0.65) ERCC5FEN1TSHRALDH1A1LMNA
SCHEMBL6581989 0.81 TGM2 (0.51) ERCC5FEN1TDP1ALDH1A1LMNA
SCHEMBL6580285 0.81 POLB (0.58) TSHRALDH1A1LMNARAB9AHTT
SCHEMBL6582004 0.79 POLB (0.40) FLT1KDRMDM2TSHRALDH1A1
SCHEMBL6581880 0.79 POLB (0.43) FLT1KDRTSHRALDH1A1HPGD
SCHEMBL11069413 0.75 ALDH1A1 (0.52) ERCC5FEN1HDAC6TSHRALDH1A1
Potassium Ion SCHEMBL11074604 0.73 ALDH1A1 (0.50) ERCC5FEN1HDAC6TSHRALDH1A1

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