SCHEMBL7662937

SCHEMBL7662937

CO/C=C(/C(=O)OC)c1ccccc1COC(=O)Nc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43
HIF1A Q16665 1/20 0.43
TP53 P04637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL7662940 1.00 LMNA (0.43) LMNAMAPTHTTSMN1; SMN2NPC1
SCHEMBL7661046 0.85 RXFP1 (0.49) LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL7661053 0.85 RXFP1 (0.49) LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL10387140 0.82 PPARG (0.47) LMNAMAPTNPC1RAB9AKMT2A
SCHEMBL10387139 0.82 PPARG (0.47) LMNAMAPTNPC1RAB9AKMT2A
SCHEMBL7662861 0.82 ALDH1A1 (0.41) LMNASMN1; SMN2ALDH1A1HIF1ATDP1
SCHEMBL7662857 0.82 ALDH1A1 (0.41) LMNASMN1; SMN2ALDH1A1HIF1ATDP1
SCHEMBL9262554 0.80 HIF1A (0.50) SMN1; SMN2ALDH1A1HIF1ATDP1
SCHEMBL7172810 0.80 HIF1A (0.50) SMN1; SMN2ALDH1A1HIF1ATDP1
SCHEMBL7172808 0.80 HIF1A (0.50) SMN1; SMN2ALDH1A1HIF1ATDP1

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
US-6465457-B1 CONTROLLING PATHOGENS ON PLANTS OR SEEDS ZENECA LIMITED (GB) 2002-10-15 US disclosed
US-5585513-A CHEMICAL INTERMEDIATES ZENECA LIMITED (GB) 1996-12-17 US disclosed
WO-1993007116-A1 FUNGICIDES ZENECA LIMITED (GB) 1993-04-15 WO disclosed