SCHEMBL5134036

SCHEMBL5134036

CCCCCC(OC)c1ccco1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
SLC37A4 O43826 1/20 0.37
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
HPGD P15428 2/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 2/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPT P10636 2/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GAA P10253 1/20 0.33
HDAC3 O15379 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
RAB9A P51151 1/20 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
SCHEMBL5133109 0.98 MEN1 (0.40) MEN1KMT2ASLC37A4SLC6A2SLC6A4
SCHEMBL5133451 0.95 MEN1 (0.40) MEN1KMT2ASLC37A4SLC6A2SLC6A4
SCHEMBL11007558 0.85 L3MBTL1 (0.38) MEN1KMT2ASLC6A2SLC6A4L3MBTL1
SCHEMBL1287682 0.82 KMT2A (0.38) MEN1KMT2ASLC6A2SLC6A4L3MBTL1
SCHEMBL10090164 0.80 KMT2A (0.38) MEN1KMT2ASLC6A2SLC6A4L3MBTL1
SCHEMBL11007405 0.79 SLC6A2 (0.38) MEN1KMT2ASLC6A2SLC6A4L3MBTL1
SCHEMBL7795384 0.78 KMT2A (0.43) MEN1KMT2AL3MBTL1HPGDPOLB
SCHEMBL18934219 0.77 MEN1 (0.41) MEN1KMT2AGAAHDAC3
SCHEMBL30264728 0.77 KMT2A (0.42) MEN1KMT2AL3MBTL1HPGDPOLB
SCHEMBL8159767 0.77 MEN1 (0.41) MEN1KMT2AGAAHDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4536349-A Furan derivatives useful as aroma compounds NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1985-08-20 US claimed
EP-1949470-A1 POLYMERIC NANOFIBRIL NETWORK FOR PHOTOVOLTAIC CELLS COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2008-07-30 EP disclosed
WO-2007048909-A1 POLYMERIC NANOFIBRIL NETWORK FOR PHOTOVOLTAIC CELLS COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2007-05-03 WO disclosed
US-4536349-A Furan derivatives useful as aroma compounds NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1985-08-20 US disclosed