SCHEMBL8798368

SCHEMBL8798368

CCOC(=O)CCCCCN(C(=O)Nc1cc(OC)cc(C(C)(C)C)c1OCOC)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 2/20 0.34
LTA4H P09960 4/20 0.33
PPARG P37231 1/20 0.33
NPC1 O15118 1/20 0.32
JAK2 O60674 1/20 0.32
RAB9A P51151 1/20 0.32
PAX8 Q06710 1/20 0.32
PTPN1 P18031 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
ALOX5 P09917 1/20 0.32
CDC25B P30305 1/20 0.32
TRPM8 Q7Z2W7 1/20 0.32
LMNA P02545 1/20 0.31
CNR1 P21554 1/20 0.31

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
SCHEMBL8798099 0.91 VCAM1 (0.34) ALDH1A1LTA4HPPARGKMT2AMTNR1A
SCHEMBL8804341 0.87 LMNA (0.34) PPARGNPC1TDP1MAPK1KMT2A
SCHEMBL8798554 0.86 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL8798530 0.84 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL8798986 0.80 MAPT (0.32) ALDH1A1TDP1MAPK1KMT2ACNR1
SCHEMBL8799596 0.78 VCAM1 (0.39) LTA4HPPARGNPC1JAK2RAB9A
SCHEMBL8798236 0.74 MEN1 (0.36) PPARGNPC1TDP1MAPK1KMT2A
SCHEMBL8798797 0.73 NPC1 (0.36) ALDH1A1PPARGNPC1RAB9ATDP1
SCHEMBL8703601 0.72 MAPK14 (0.47) SMN1; SMN2ALDH1A1NPC1RAB9AMAPK1
SCHEMBL8799725 0.68 ACHE (0.37) PPARGNPC1RAB9ATDP1

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-0790240-A1 Phenol-derivatives having pharmaceutical activity and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1997-08-20 EP disclosed