SCHEMBL28847868

SCHEMBL28847868

COc1ccccc1OC(=O)CCCCC(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.58
▸ POLB P06746 3/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ RECQL P46063 1/20 0.53
▸ MAPT P10636 3/20 0.51
▸ ALDH1A1 P00352 2/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ PTGS2 P35354 1/20 0.47
▸ FABP4 P15090 1/20 0.45
▸ HDAC3 O15379 1/20 0.44
▸ HDAC4 P56524 1/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ HDAC7 Q8WUI4 1/20 0.44
▸ HDAC2 Q92769 1/20 0.44
▸ HDAC10 Q969S8 1/20 0.44
▸ HDAC11 Q96DB2 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44

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
SCHEMBL5701570 0.93 KMT2A (0.56) LMNAPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL3361878 0.90 LMNA (0.62) LMNAPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL28936425 0.90 KMT2A (0.56) LMNAPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL4090350 0.87 MEN1 (0.60) POLBSMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL4643517 0.87 KMT2A (0.51) LMNAPOLBSMN1; SMN2KMT2AMEN1
1,2-Dimethoxybenzene SCHEMBL31672175 0.86 LMNA (0.70) LMNAPOLBSMN1; SMN2KMT2AHDAC3
SCHEMBL3361882 0.86 KMT2A (0.59) LMNAPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL4646275 0.85 KMT2A (0.50) LMNAPOLBSMN1; SMN2KMT2AMEN1
SCHEMBL4083649 0.85 MEN1 (0.59) POLBSMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL22975372 0.85 MEN1 (0.59) POLBSMN1; SMN2KMT2AMEN1KDM4E

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-104797628-B The manufacture method of aromatic polycarbonate resin through molecular weight 三菱瓦斯化学株式会社 2017-08-11 — — CN disclosed
Send feedback