SCHEMBL27290347

SCHEMBL27290347

COC(=O)c1oc(OC(C)C)c2cccc(-c3ccccc3)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
FGFR1 P11362 1/20 0.39
SRC P12931 1/20 0.39
FGFR2 P21802 1/20 0.39
FGFR4 P22455 1/20 0.39
FGFR3 P22607 1/20 0.39
PPARG P37231 4/20 0.38
PPARA Q07869 4/20 0.38
TOP2A P11388 1/20 0.37
ALDH1A1 P00352 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HTT P42858 2/20 0.36
NPC1 O15118 2/20 0.36
GAA P10253 2/20 0.36
MAPT P10636 2/20 0.36
MAPK1 P28482 2/20 0.36
RAB9A P51151 2/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
PTGS1 P23219 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
SCHEMBL10372180 0.89 PPARG (0.40) KDM4EPPARGPPARAALDH1A1SMN1; SMN2
SCHEMBL10372531 0.81 EDNRA (0.41) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL27290346 0.78 KLKB1 (0.45) KDM4EFGFR1SRCFGFR2FGFR4
SCHEMBL10372057 0.77 ADCY1 (0.36) KDM4EPPARGPPARAALDH1A1HTT
SCHEMBL10373608 0.77 EDNRA (0.40) KDM4EALDH1A1SMN1; SMN2HTTNPC1
SCHEMBL27280518 0.77 NR4A2 (0.44) KDM4EALDH1A1SMN1; SMN2HTTNPC1
SCHEMBL10373898 0.72 EDNRA (0.51) KDM4EALDH1A1SMN1; SMN2HTTGAA
SCHEMBL9434171 0.71 KMT2A (0.40) KDM4EALDH1A1SMN1; SMN2NPC1GAA
SCHEMBL10373085 0.71 ALDH1A1 (0.44) KDM4EALDH1A1SMN1; SMN2NPC1MAPT
SCHEMBL27283282 0.70 KDM4E (0.43) KDM4EFGFR1SRCFGFR2FGFR4

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
CN-1007153-B PREPN. OF BENZOTHIOPHENES AND BENZOFURANS HAVING ANTIALLERGY ACTIVITY WARNER LAMBERT CO (US) 1990-03-14 CN disclosed
CN-85109587-A Have the new benzothiophene kind of antiallergic activity and the preparation method of benzofuran compounds 1986-12-17 CN disclosed