SCHEMBL2299272

SCHEMBL2299272

C[C](Cc1ccc(C)cc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.49
TDP1 Q9NUW8 1/20 0.49
KMT2A Q03164 4/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
MEN1 O00255 3/20 0.47
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
LMNA P02545 4/20 0.43
POLB P06746 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CTBP2 P56545 1/20 0.43
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41

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
SCHEMBL6986997 0.92 KMT2A (0.51) L3MBTL1TDP1KMT2ANPC1RAB9A
SCHEMBL153922 0.87 CES1 (0.48) L3MBTL1KMT2AMEN1CES2CES1
SCHEMBL6309158 0.82 L3MBTL1 (0.52) L3MBTL1TDP1KMT2ANPC1RAB9A
SCHEMBL29271945 0.81 L3MBTL1 (0.50) L3MBTL1TDP1KMT2ANPC1RAB9A
SCHEMBL6547513 0.80 L3MBTL1 (0.46) L3MBTL1TDP1KMT2ANPC1RAB9A
SCHEMBL160620 0.78 NPC1 (0.68) L3MBTL1TDP1KMT2ANPC1RAB9A
SCHEMBL6546799 0.78 L3MBTL1 (0.47) L3MBTL1TDP1KMT2ANPC1RAB9A
SCHEMBL4125045 0.76 ALDH1A1 (0.51) LMNA
Toluene SCHEMBL9293975 0.75 L3MBTL1 (0.58) L3MBTL1TDP1KMT2ANPC1RAB9A
Toluene SCHEMBL1118344 0.75 L3MBTL1 (0.58) L3MBTL1TDP1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011120475-A1 A METHOD OF MANUFACTURING (S)-5-METHOXY-2-[[(4-METHOXY-3,5-DIMETHYL-2- PYRIMIDINYL)METHYL]SULFINYL]-1H-BENZIMIDAZOLE USING A CHIRAL COMPLEX WITH MANDELIC ACID ZENTIVA, K.S. (CZ) 2011-10-06 WO disclosed
EP-1809704-B1 COATING COMPOSITIONS CONTAINING A CARBINOL FUNCTIONAL SILICONE RESIN OR AN ANHYDRIDE FUNCTIONAL SILICONE RESIN DOW CORNING (US) 2011-08-17 EP disclosed
CN-101048464-B Coating compositions containing a carbinol functional silicone resin or an anhydride functional silicone resin DOW CORNING INC 2011-04-20 CN disclosed
CN-101048464-A Coating compositions containing a carbinol functional silicone resin or an anhydride functional silicone resin DOW CORNING (US) 2007-10-03 CN disclosed
EP-1809704-A1 COATING COMPOSITIONS CONTAINING A CARBINOL FUNCTIONAL SILICONE RESIN OR AN ANHYDRIDE FUNCTIONAL SILICONE RESIN Dow Corning Corporation (US) 2007-07-25 EP disclosed
WO-2006047319-A1 COATING COMPOSITIONS CONTAINING A CARBINOL FUNCTIONAL SILICONE RESIN OR AN ANHYDRIDE FUNCTIONAL SILICONE RESIN DOW CORNING CORPORATION (US) 2006-05-04 WO disclosed