SCHEMBL7181018

SCHEMBL7181018

C=CNOC(=O)CCCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
CNR2 P34972 1/20 0.50
DGKA P23743 1/20 0.50
FAAH O00519 1/20 0.47
LMNA P02545 4/20 0.47
POLB P06746 1/20 0.46
POLA1 P09884 1/20 0.46
PAM P19021 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.44
MAPK1 P28482 1/20 0.44
CES2 O00748 3/20 0.43
CES1 P23141 3/20 0.43
HSP90AA1 P07900 1/20 0.42
DNM1 Q05193 1/20 0.42

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
SCHEMBL27700699 0.83 DGKA (0.52) TSHRCNR2DGKALMNAPOLB
SCHEMBL27482958 0.83 DGKA (0.52) TSHRCNR2DGKALMNAPOLB
SCHEMBL991447 0.81 CNR2 (0.49) TSHRCNR2DGKALMNAPOLB
SCHEMBL27630679 0.79 TSHR (0.53) TSHRCNR2DGKAFAAHLMNA
SCHEMBL28328608 0.79 TSHR (0.53) TSHRCNR2DGKAFAAHLMNA
SCHEMBL22129994 0.79 TSHR (0.53) TSHRCNR2DGKAFAAHLMNA
SCHEMBL1018382 0.79 TSHR (0.53) TSHRCNR2DGKAFAAHLMNA
SCHEMBL20699246 0.79 TSHR (0.53) TSHRCNR2DGKAFAAHLMNA
SCHEMBL27868024 0.79 TSHR (0.53) TSHRCNR2DGKAFAAHLMNA
SCHEMBL2399372 0.77 TSHR (0.51) TSHRCNR2DGKAFAAHLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6559209-B1 Method of making a rubber composition which is improved in a dispersibility of silica into rubber, a heat generating property and an abrasion property. The rubber composition comprises 15 to 85 parts by weight of silica per 100 parts of BRIDGESTONE CORPORATION (JP) 2003-05-06 US disclosed
EP-0846724-A2 RUBBER COMPOSITION AND PNEUMATIC TIRE Bridgestone Corporation (JP) 1998-06-10 EP disclosed