SCHEMBL6582834

SCHEMBL6582834

CCOC(=O)n1nnnc1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.44
ALDH1A1 P00352 6/20 0.38
FAAH O00519 2/20 0.37
NPSR1 Q6W5P4 1/20 0.35
TP53 P04637 2/20 0.35
ALOX12 P18054 1/20 0.35
PKM P14618 1/20 0.34
ATM Q13315 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
USP2 O75604 1/20 0.33
NPC1 O15118 1/20 0.33
MGLL Q99685 2/20 0.32

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
SCHEMBL6580348 0.86 MAPK1 (0.47) MAPK1ALDH1A1FAAHNPSR1TP53
SCHEMBL6581481 0.81 FAAH (0.36) FAAHMGLL
SCHEMBL20816368 0.78 DAGLA (0.30) FAAH
SCHEMBL8921457 0.72 MAPK1 (0.53) MAPK1ALDH1A1PKMATMHSD17B10
SCHEMBL6580324 0.70 MAPK1 (0.42) MAPK1ALDH1A1NPSR1HSD17B10LMNA
SCHEMBL6948864 0.69 NPC1 (0.48) MAPK1ALDH1A1NPSR1TP53SMN1; SMN2
SCHEMBL9881652 0.69 MAPK1 (0.45) MAPK1ALDH1A1TP53ALOX12LMNA
SCHEMBL11776322 0.68 MAPK1 (0.51) MAPK1ALDH1A1TP53ALOX12SMN1; SMN2
SCHEMBL9920433 0.68 MAPK1 (0.44) MAPK1ALDH1A1TP53ALOX12SMN1; SMN2
SCHEMBL28712647 0.67 HSD17B10 (0.43) MAPK1ALDH1A1HSD17B10SMN1; SMN2LMNA

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