SCHEMBL6580464

SCHEMBL6580464

Cc1ccc(Cc2ccc(C(=O)Nc3cccc(C(=O)CO)c3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 2/20 0.58
MAPT P10636 3/20 0.54
NPSR1 Q6W5P4 1/20 0.54
CES1 P23141 1/20 0.51
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
KCNK3 O14649 3/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
KCNK9 Q9NPC2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KCNH2 Q12809 1/20 0.50
POLB P06746 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
MET P08581 1/20 0.49

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
SCHEMBL6580248 0.93 NR1H4 (0.57) NR1H4MAPTCES1NPC1RAB9A
SCHEMBL6579969 0.87 KMT2A (0.58) MAPTNPSR1NPC1RAB9AKCNK3
SCHEMBL6582800 0.86 KCNK9 (0.64) NPC1RAB9AKCNK3MEN1KMT2A
SCHEMBL6580479 0.86 NR1H4 (0.80) NR1H4MAPTNPC1RAB9AMEN1
SCHEMBL6580260 0.85 TRPV1 (0.56) NR1H4MAPTNPC1RAB9AKCNK3
SCHEMBL6346822 0.82 KCNK3 (0.71) MAPTNPC1RAB9AKCNK3MEN1
SCHEMBL6579939 0.81 TRPV1 (0.67) NR1H4NPC1RAB9AMEN1KMT2A
SCHEMBL6577998 0.80 NR1H4 (0.65) NR1H4MAPTRAB9AKCNK3MEN1
SCHEMBL6577802 0.80 NR1H4 (0.62) NR1H4RAB9AKCNK3MEN1KMT2A
SCHEMBL8737967 0.79 KCNK3 (0.64) MAPTCES1NPC1RAB9AKCNK3

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