SCHEMBL6889937

SCHEMBL6889937

CC1=C(C)C([Ti](NC(=O)C2CCCCCCCCCCC2)(OC(C)C)OC(C)C)c2cc(C)cc(C)c21.[SiH4]

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 9/20 0.36
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TAS1R3 Q7RTX0 2/20 0.34
TAS1R1 Q7RTX1 2/20 0.34
TAS1R2 Q8TE23 2/20 0.34
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL8026990 0.72 TSHR (0.37) EPHX2LMNAKMT2A
SCHEMBL7629470 0.68 NPSR1 (0.41) EPHX2LMNANPSR1TAS1R3TAS1R1
SCHEMBL7743272 0.62 CYP2C19 (0.41) LMNANPSR1GAAKMT2A
SCHEMBL14503300 0.61 NPSR1 (0.65) LMNANPSR1GAAKMT2A
SCHEMBL7630278 0.60 TAS1R3 (0.33) EPHX2LMNANPSR1TAS1R3TAS1R1
SCHEMBL22430566 0.57 NPSR1 (0.62) LMNANPSR1GAAKMT2A
SCHEMBL12218523 0.57 NPSR1 (0.96) LMNANPSR1GAAKMT2A
SCHEMBL7742391 0.56 TAS1R3 (0.38) EPHX2TAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL8024127 0.56 TAS1R3 (0.37) EPHX2TAS1R3TAS1R1TAS1R2KMT2A
SCHEMBL6469289 0.56 HDAC8 (0.36) LMNANPSR1GAAKMT2A

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
EP-1377613-A2 METHOD OF MAKING INTERPOLYMERS AND PRODUCTS MADE THEREFROM DOW GLOBAL TECHNOLOGIES INC. (US) 2004-01-07 EP disclosed
WO-2002074817-A2 METHOD OF MAKING INTERPOLYMERS AND PRODUCTS MADE THEREFROM DOW GLOBAL TECHNOLOGIES INC. (US) 2002-09-26 WO disclosed
EP-0977787-A1 OLEFIN POLYMERS PREPARED WITH SUBSTITUTED INDENYL CONTAINING METAL COMPLEXES THE DOW CHEMICAL COMPANY (US) 2000-02-09 EP disclosed
WO-1998049211-A1 OLEFIN POLYMERS PREPARED WITH SUBSTITUTED INDENYL CONTAINING METAL COMPLEXES THE DOW CHEMICAL COMPANY (US) 1998-11-05 WO disclosed
EP-0874860-A1 SUBSTITUTED INDENYL CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1998-11-04 EP disclosed
WO-1997015583-A1 SUBSTITUTED INDENYL CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1997-05-01 WO disclosed