SCHEMBL9846360

SCHEMBL9846360

CCCOc1ccccc1OC(OC)=C(C(=O)O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.43
MAPT P10636 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
GAA P10253 1/20 0.42
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
HIF1A Q16665 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 1/20 0.40
PKM P14618 1/20 0.40
HTT P42858 1/20 0.40
NLRP1 Q9C000 1/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
AKR1C3 P42330 1/20 0.38
SLC6A3 Q01959 1/20 0.38

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
SCHEMBL9874009 0.76 LMNA (0.50) LMNAMAPTL3MBTL1GAAKMT2A
SCHEMBL6206065 0.75 TSHR (0.47) MAPTL3MBTL1GAAKMT2ANPC1
SCHEMBL9873999 0.73 NPC1 (0.48) LMNAMAPTL3MBTL1GAAKMT2A
SCHEMBL11038164 0.73 LMNA (0.47) LMNAMAPTGAAKMT2AMEN1
SCHEMBL8341436 0.72 ALDH1A1 (0.57) LMNAMAPTGAAKMT2AMEN1
SCHEMBL11040076 0.71 NPSR1 (0.59) MAPTGAAKMT2AMEN1NPC1
SCHEMBL8084797 0.71 NPC1 (0.47) LMNAMAPTL3MBTL1GAAKMT2A
SCHEMBL10962581 0.71 NPC1 (0.50) LMNAMAPTL3MBTL1GAAKMT2A
SCHEMBL6577955 0.71 KMT2A (0.47) LMNAMAPTL3MBTL1GAAKMT2A
1,2-Dipropoxybenzene SCHEMBL29428926 0.70 CYP1A2 (0.56) LMNAMAPTL3MBTL1GAAKMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0415569-A2 Agrochemical compositions ZENECA LIMITED (GB) 1991-03-06 EP disclosed