SCHEMBL28001069

SCHEMBL28001069

CC(O)COc1ccc(F)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
MAOB P27338 3/20 0.45
AOC3 Q16853 1/20 0.45
ADRB2 P07550 2/20 0.40
MAOA P21397 2/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 2/20 0.39
HRH3 Q9Y5N1 1/20 0.38
KCNH2 Q12809 1/20 0.38
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CARM1 Q86X55 1/20 0.37
PRMT6 Q96LA8 1/20 0.37

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
SCHEMBL8258103 0.86 LMNA (0.50) LMNAADRB2ADRB1ADRB3HRH3
SCHEMBL16179945 0.81 MAOB (0.41) MAOBAOC3MAOACARM1PRMT6
SCHEMBL5949941 0.80 LMNA (0.78) LMNAADRB2ADRB1ADRB3SMN1; SMN2
SCHEMBL15664329 0.79 KMT2A (0.56) MAOBAOC3ADRB3KCNH2KMT2A
SCHEMBL1835550 0.79 LMNA (0.64) LMNAKCNH2KMT2A
SCHEMBL1840653 0.79 LMNA (0.64) LMNAKCNH2KMT2A
SCHEMBL6273026 0.79 LMNA (0.64) LMNAKCNH2KMT2A
SCHEMBL5962530 0.78 MAOB (0.41) MAOBAOC3MAOAADRB3
SCHEMBL1241813 0.76 LMNA (0.73) LMNAADRB2ADRB1ADRB3SMN1; SMN2
SCHEMBL11459339 0.76 LMNA (0.55) LMNAKMT2ASMN1; SMN2

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
CN-104447792-A Substituted dihydro and tetrahydro oxazolopyrimidinones, preparation and use thereof SANOFI AVENTIS 2015-03-25 CN disclosed