SCHEMBL9602550

SCHEMBL9602550

C=Cc1ccccc1CN(CCCCCCCC)CCCCCCCC

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.44
BCHE P06276 5/20 0.43
ICMT O60725 1/20 0.41
ALB P02768 1/20 0.41
ACHE P22303 3/20 0.40
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
DRD2 P14416 1/20 0.38
OPRM1 P35372 1/20 0.38
DRD3 P35462 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
LIPG Q9Y5X9 1/20 0.37

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
SCHEMBL9603105 1.00 KCNH2 (0.44) KCNH2BCHEICMTALBACHE
SCHEMBL9779280 1.00 KCNH2 (0.44) KCNH2BCHEICMTALBACHE
SCHEMBL3474155 1.00 KCNH2 (0.44) KCNH2BCHEICMTALBACHE
SCHEMBL8415450 0.93 MEN1 (0.42) KCNH2BCHEACHEMEN1KMT2A
SCHEMBL10991195 0.88 CHRM2 (0.48) BCHEACHETHRATHRBKMT2A
SCHEMBL3475302 0.88 CHRM2 (0.48) BCHEACHETHRATHRBKMT2A
SCHEMBL1336874 0.88 KCNH2 (0.49) KCNH2BCHEICMTALBTHRA
SCHEMBL11154552 0.87 ICMT (0.39) KCNH2BCHEICMTALBACHE
SCHEMBL11147722 0.87 ICMT (0.39) KCNH2BCHEICMTALBACHE
SCHEMBL11155416 0.87 ICMT (0.39) KCNH2BCHEICMTALBACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0330772-B1 METHOD OF DOUBLE DECOMPOSITION OF NEUTRAL SALT TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1993-05-26 EP disclosed
US-5015551-A Resin particles dispersed in a dielectric nonaqueous solvent for making printing plates or sheets FUJI PHOTO FILM CO., LTD. (JP) 1991-05-14 US disclosed
EP-0330772-A1 Method of double decomposition of neutral salt TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1989-09-06 EP disclosed
US-4806219-A ELECTRODIALYSIS CELLS CONTAINING ION EXCHANGE MEMBRANES TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1989-02-21 US disclosed
US-4734351-A DISPERSION OF POLYMER FUJI PHOTO FILM CO., LTD. (JP) 1988-03-29 US disclosed
US-4543216-A REACTING A VINYL BENZYL HALIDE WITH AN AMINO ACID OR AMINO SULFONIC ACID NIPPON PAINT CO., LTD. (JP) 1985-09-24 US disclosed
US-4473630-A Liquid developer comprising aminoalkyl styrene polymer for electrostatic images FUJI PHOTO FILM CO., LTD. (JP) 1984-09-25 US disclosed
US-4452746-A TO MODIFY PROPERTIES OF HIGH MOLECULAR WEIGHT COMPOUNDS NIPPON PAINT CO., LTD. (JP) 1984-06-05 US disclosed