SCHEMBL6580139

SCHEMBL6580139

CCOc1ccc(C(=O)Nc2ccc(O)c(C(C)=O)c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.63
KDM4E B2RXH2 2/20 0.63
ALDH1A1 P00352 2/20 0.63
CYP1A2 P05177 1/20 0.63
RAB9A P51151 8/20 0.61
SMN1; SMN2 Q16637 6/20 0.61
TP53 P04637 3/20 0.61
KMT2A Q03164 9/20 0.60
MEN1 O00255 6/20 0.60
LMNA P02545 3/20 0.60
HTT P42858 1/20 0.60
MAPT P10636 4/20 0.57
POLB P06746 2/20 0.57
MAPK1 P28482 1/20 0.56
APOBEC3A P31941 1/20 0.56
APOBEC3G Q9HC16 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
GAA P10253 1/20 0.55
P4HTM Q9NXG6 1/20 0.55
FADS1 O60427 1/20 0.55

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
SCHEMBL6582685 0.90 MAPT (0.63) NPC1KDM4EALDH1A1RAB9ASMN1; SMN2
SCHEMBL6579798 0.90 NR1H4 (0.61) NPC1KDM4EALDH1A1RAB9ASMN1; SMN2
SCHEMBL6580095 0.85 NPC1 (0.67) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL6581663 0.83 MAPT (0.58) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL6581908 0.82 NPC1 (0.56) NPC1ALDH1A1CYP1A2RAB9ASMN1; SMN2
SCHEMBL6582707 0.82 TRPV1 (0.52) NPC1KDM4EALDH1A1RAB9ASMN1; SMN2
SCHEMBL6581838 0.81 NR1H4 (0.68) NPC1RAB9ASMN1; SMN2TP53KMT2A
SCHEMBL10880536 0.80 NPC1 (0.78) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL6580244 0.80 NPC1 (0.64) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL3652542 0.80 MAOB (0.61) NPC1KDM4EALDH1A1RAB9ASMN1; 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