SCHEMBL6979935

SCHEMBL6979935

CCOC(=O)NCCc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.67
KMT2A Q03164 1/20 0.67
HDAC3 O15379 1/20 0.63
HDAC4 P56524 1/20 0.63
HDAC1 Q13547 1/20 0.63
HDAC7 Q8WUI4 1/20 0.63
HDAC2 Q92769 1/20 0.63
HDAC10 Q969S8 1/20 0.63
HDAC11 Q96DB2 1/20 0.63
HDAC8 Q9BY41 1/20 0.63
HDAC6 Q9UBN7 1/20 0.63
HDAC9 Q9UKV0 1/20 0.63
HDAC5 Q9UQL6 1/20 0.63
NCOR2 Q9Y618 1/20 0.63
TRPM8 Q7Z2W7 1/20 0.63
MAPT P10636 2/20 0.62
L3MBTL1 Q9Y468 2/20 0.62
NPC1 O15118 2/20 0.59
RAB9A P51151 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.59

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
SCHEMBL16552358 0.88 NPC1 (0.63) KMT2AMAPTL3MBTL1NPC1RAB9A
SCHEMBL158220 0.87 HDAC3 (0.78) GLAKMT2AHDAC3HDAC4HDAC1
SCHEMBL1437584 0.86 FFAR1 (0.65) KMT2AFFAR1FFAR4BCHE
SCHEMBL11879443 0.84 EGFR (0.58) HDAC3HDAC1HDAC2NCOR2TRPM8
SCHEMBL3004957 0.83 FFAR1 (0.55) KMT2AHDAC1MAPTL3MBTL1NPC1
SCHEMBL13535161 0.83 L3MBTL1 (0.63) GLAKMT2AMAPTL3MBTL1NPC1
SCHEMBL8737718 0.81 NPC1 (0.72) GLAKMT2AMAPTL3MBTL1NPC1
SCHEMBL793998 0.80 GLA (1.00) GLAKMT2AHDAC3HDAC4HDAC1
SCHEMBL20497343 0.80 L3MBTL1 (0.63) KMT2AHDAC3HDAC4HDAC1HDAC7
SCHEMBL11307142 0.80 L3MBTL1 (0.70) GLAKMT2AMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0821719-B1 LIQUID CRYSTAL COMPOUNDS HAVING A CHIRAL FLUORINATED TERMINAL PORTION MINNESOTA MINING & MFG (US) 2003-01-02 EP disclosed
US-5972241-A ELECTROOPTICAL APPLICATIONS, IN PARTICULAR THOSE WHICH REQUIRE COMPACT, ENERGY-EFFICIENT, VOLTAGE-CONTROLLED LIGHT VALVES, E.G., WATCHES AND COMPUTERS 3M INNOVATIVE PROPERTIES COMPANY (US) 1999-10-26 US disclosed
EP-0821719-A1 LIQUID CRYSTAL COMPOUNDS HAVING A CHIRAL FLUORINATED TERMINAL PORTION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-02-04 EP disclosed
US-5702637-A DISPLAY DEVICES WITH FAST RESPONSE TIMES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-12-30 US disclosed
WO-1996033251-A1 LIQUID CRYSTAL COMPOUNDS HAVING A CHIRAL FLUORINATED TERMINAL PORTION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-10-24 WO disclosed