SCHEMBL98971

SCHEMBL98971

C=Cc1ccc(N(C)CCO[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DUT P33316 2/20 0.34
NTSR1 P30989 1/20 0.33
ALDH1A1 P00352 2/20 0.31
DGAT1 O75907 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA7 P36544 1/20 0.31
CHRNA4 P43681 1/20 0.31

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
SCHEMBL98656 0.87 ALDH1A1 (0.34) DUTALDH1A1KDM4EMAPTCHRNB2
SCHEMBL12422405 0.86 CYP2A6 (0.42) DUTNTSR1ALDH1A1DGAT1KDM4E
SCHEMBL5855038 0.83 ALDH1A1 (0.37) DUTNTSR1ALDH1A1DGAT1KDM4E
SCHEMBL5854799 0.81 DUT (0.39) DUTNTSR1ALDH1A1DGAT1KDM4E
SCHEMBL12422407 0.79 KDM4E (0.38) DUTNTSR1ALDH1A1KDM4EMAPT
SCHEMBL4346296 0.76 NR1H2 (0.41) DUTNTSR1DGAT1KMT2A
SCHEMBL9348333 0.76 ALDH1A1 (0.35) DUTALDH1A1CHRNB2CHRNB4CHRNA3
SCHEMBL2946055 0.75 APP (0.33) DUTNTSR1DGAT1
SCHEMBL14648388 0.75 CHRNA7 (0.49) DUTALDH1A1KDM4EMAPTKMT2A
SCHEMBL2941957 0.73 NTSR1 (0.32) DUTNTSR1DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9260540-B1 Method of making a functionalized polymer with sulfide linkage BRIDGESTONE CORPORATION (JP) 2016-02-16 US disclosed
US-9260540-B1 Method of making a functionalized polymer with sulfide linkage BRIDGESTONE CORPORATION (JP) 2016-02-16 US disclosed
US-9221923-B2 Coupled polymers and methods for making same BRIDGESTONE CORPORATION (JP) 2015-12-29 US disclosed
US-9221923-B2 Coupled polymers and methods for making same BRIDGESTONE CORPORATION (JP) 2015-12-29 US disclosed
US-8637600-B2 Processing of rubber compositions including siliceous fillers BRIDGESTONE CORPORATION (JP) 2014-01-28 US disclosed
US-8637600-B2 Processing of rubber compositions including siliceous fillers BRIDGESTONE CORPORATION (JP) 2014-01-28 US disclosed
US-8586691-B2 Method of making a blocked polymer with a siloxane linking group BRIDGESTONE CORPORATION (JP) 2013-11-19 US disclosed
US-20130274408-A1 Coupled Polymers And Methods For Making Same BRIDGESTONE CORPORATION (JP) 2013-10-17 US disclosed
US-20130274408-A1 Coupled Polymers And Methods For Making Same BRIDGESTONE CORPORATION (JP) 2013-10-17 US disclosed
US-20130035443-A1 METHOD OF MAKING A BLOCKED POLYMER WITH A SILOXANE LINKING GROUP BRIDGESTONE CORPORATION (JP) 2013-02-07 US disclosed
US-20120059113-A1 PROCESSING OF RUBBER COMPOSITIONS INCLUDING SILICEOUS FILLERS BRIDGESTONE CORPORATION (JP) 2012-03-08 US disclosed