SCHEMBL6580176

SCHEMBL6580176

CC(CCOc1ccc(C(=O)Nc2cccc(C(=O)CO)c2)cc1)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 13/20 0.66
NPC1 O15118 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
PAX8 Q06710 1/20 0.50
KCNK9 Q9NPC2 1/20 0.50
MAPT P10636 4/20 0.49
TP53 P04637 2/20 0.49
HTT P42858 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
RXFP1 Q9HBX9 1/20 0.48

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
SCHEMBL6577705 0.82 NR1H4 (0.78) NR1H4NPC1MEN1KMT2AMAPT
SCHEMBL6580077 0.82 NR1H4 (0.70) NR1H4NPC1MEN1KMT2AMAPT
SCHEMBL6581896 0.82 NR1H4 (0.72) NR1H4NPC1MEN1KMT2AKCNK9
SCHEMBL8108301 0.81 NR1H4 (0.78) NR1H4NPC1MEN1KMT2AKCNK9
SCHEMBL6580184 0.80 NR1H4 (0.58) NR1H4NPC1MEN1KMT2APAX8
SCHEMBL6579950 0.80 NPC1 (0.73) NR1H4NPC1MEN1KMT2APAX8
SCHEMBL8119505 0.80 NR1H4 (0.83) NR1H4NPC1MEN1KMT2ARAB9A
SCHEMBL6165569 0.80 NR1H4 (0.83) NR1H4NPC1MEN1KMT2ARAB9A
SCHEMBL6580199 0.80 NR1H4 (0.54) NR1H4NPC1MEN1KMT2AMAPT
SCHEMBL7477030 0.80 NR1H4 (0.52) NR1H4NPC1MEN1KMT2AKCNK9

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