SCHEMBL6581440

SCHEMBL6581440

CC(C)(C)OC(=O)n1nnnc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.58
MAPT P10636 1/20 0.34
GRM1 Q13255 3/20 0.33
GRM5 P41594 2/20 0.33
HTT P42858 1/20 0.33
ATM Q13315 1/20 0.33
ELANE P08246 1/20 0.33
USP2 O75604 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
BCHE P06276 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
ADORA1 P30542 1/20 0.30
GPR119 Q8TDV5 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
SCHEMBL6581481 0.80 FAAH (0.36) FAAH
SCHEMBL6582834 0.77 MAPK1 (0.44) FAAHMAPTATMUSP2SMN1; SMN2
SCHEMBL4358478 0.77 FAAH (0.59) FAAHMAPTHTTATMELANE
SCHEMBL20816368 0.77 DAGLA (0.30) FAAH
SCHEMBL14994169 0.73 FAAH (1.00) FAAHMAPTHTTATMELANE
SCHEMBL8923623 0.68 HCAR3 (0.40) FAAH
SCHEMBL3671626 0.65
SCHEMBL22233152 0.64 FAAH (0.39) FAAHELANEUSP2SMN1; SMN2BCHE
SCHEMBL8923370 0.64 HCAR3 (0.31)
SCHEMBL10522299 0.63 FAAH (0.41) FAAHMAPTSMN1; SMN2

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