SCHEMBL7697123

SCHEMBL7697123

CCOC(=O)C1=Cc2cccc(-c3ccccc3C=O)c2OCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PREP P48147 1/20 0.38
ALDH1A1 P00352 8/20 0.37
ERN1 O75460 1/20 0.37
EED O75530 1/20 0.35
MAPT P10636 7/20 0.34
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
LMNA P02545 3/20 0.34
HPGD P15428 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
ALOX12 P18054 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
PKM P14618 1/20 0.34
STAT3 P40763 1/20 0.34
HTT P42858 1/20 0.34
KCNH2 Q12809 1/20 0.34
TSHR P16473 1/20 0.34
KDM4E B2RXH2 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL7700639 0.90 ALDH1A1 (0.40) PREPALDH1A1ERN1EEDMAPT
SCHEMBL7388400 0.86 EED (0.42) PREPALDH1A1EEDMAPTMEN1
SCHEMBL7703355 0.86 PREP (0.40) PREPALDH1A1EEDMAPTHPGD
SCHEMBL7385304 0.81 MAPT (0.39) PREPALDH1A1MAPTMEN1KMT2A
SCHEMBL7699846 0.80 TSHR (0.46) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL7696668 0.80 CA12 (0.48) PREPALDH1A1MAPTLMNAALOX12
SCHEMBL7878684 0.80 USP2 (0.41) PREPALDH1A1EEDKMT2ALMNA
SCHEMBL7385154 0.79 ALDH1A1 (0.43) PREPALDH1A1MAPTMEN1KMT2A
SCHEMBL7385104 0.79 NOTUM (0.40) PREPALDH1A1MAPTMEN1KMT2A
SCHEMBL7386364 0.79 CA12 (0.37) PREPALDH1A1EEDKMT2AHPGD

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-6346527-B1 1-BENZOXEPIN DERIVATIVES USED IN THE PREVENTION OF SODIUM AND HYDROGEN ION EXCHANGE; CARDIOVASCULAR, KIDNEY AND BRAIN DISORDER TREATMENT; ARTERIOSCLEROSIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-02-12 US disclosed
EP-1073650-A1 GUANIDINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-02-07 EP disclosed
WO-1999055690-A1 GUANIDINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-11-04 WO disclosed