SCHEMBL8372736

SCHEMBL8372736

CCCC(COc1ccc(C=O)cc1)Oc1ccc(C=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A3 P47895 2/20 0.50
ALDH1A1 P00352 7/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
DRD1 P21728 1/20 0.42
CYP2A6 P11509 1/20 0.42
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RAB9A P51151 1/20 0.37
PLA2G2A P14555 2/20 0.37
ALDH3A1 P30838 1/20 0.36

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
SCHEMBL8372451 0.91 ALDH1A1 (0.48) ALDH1A3ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL8372772 0.90 ALDH1A1 (0.47) ALDH1A3ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL8371542 0.88 ALDH1A1 (0.46) ALDH1A3ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL8376309 0.88 ALDH1A1 (0.46) ALDH1A3ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL8372766 0.88 ALDH1A1 (0.46) ALDH1A3ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL8372769 0.87 ALDH1A3 (0.53) ALDH1A3ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL31395590 0.81 ALDH1A1 (0.49) ALDH1A3ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL31268591 0.79 TDP1 (0.50) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL1915714 0.78 ALDH1A3 (0.58) ALDH1A3ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL9151648 0.78 ALDH1A1 (0.46) ALDH1A3ALDH1A1SMN1; SMN2LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0802199-B1 Covalently bound dimers of glycopeptide antibiotics LILLY CO ELI (US) 1999-12-08 EP disclosed
EP-0802199-A2 Covalently bound dimers of glycopetide antibiotics ELI LILLY AND COMPANY (US) 1997-10-22 EP disclosed