SCHEMBL6579947

SCHEMBL6579947

CCOc1ccc(C(=O)Nc2cccc(C(C)=O)c2O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.67
RAB9A P51151 7/20 0.67
KMT2A Q03164 5/20 0.67
SMN1; SMN2 Q16637 5/20 0.67
MEN1 O00255 4/20 0.67
POLB P06746 1/20 0.58
KDM4E B2RXH2 3/20 0.54
CYP1A2 P05177 2/20 0.54
ALDH1A1 P00352 2/20 0.54
GAA P10253 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
LMNA P02545 4/20 0.53
TP53 P04637 4/20 0.53
HTT P42858 1/20 0.52
MAPT P10636 3/20 0.52
TSHR P16473 1/20 0.52
MAPK1 P28482 1/20 0.52
PKM P14618 1/20 0.52

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
SCHEMBL6577703 0.90 PLK1 (0.64) NPC1RAB9AKMT2ASMN1; SMN2MEN1
SCHEMBL6580071 0.90 PLK1 (0.58) NPC1RAB9AKMT2ASMN1; SMN2MEN1
SCHEMBL28418450 0.87 PLK1 (0.60) NPC1RAB9AKMT2ASMN1; SMN2MEN1
SCHEMBL6577738 0.85 NPC1 (0.63) NPC1RAB9AKMT2ASMN1; SMN2MEN1
SCHEMBL6580027 0.85 F10 (0.66) NPC1RAB9AKMT2ASMN1; SMN2MEN1
SCHEMBL6581893 0.83 BCHE (0.55) NPC1RAB9AKMT2ASMN1; SMN2MEN1
SCHEMBL6580473 0.83 NR1H4 (0.60) NPC1RAB9AKMT2ASMN1; SMN2MEN1
SCHEMBL6580051 0.83 ALDH1A1 (0.57) NPC1RAB9AKMT2ASMN1; SMN2MEN1
SCHEMBL6580181 0.83 MAPT (0.58) NPC1RAB9AKMT2ASMN1; SMN2MEN1
SCHEMBL6580254 0.83 NR1H4 (0.53) NPC1RAB9AKMT2ASMN1; SMN2MEN1

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