SCHEMBL27366899

SCHEMBL27366899

CC(C)CCc1ccc(C(=O)O)cc1.C[Sn]C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.53
GRIN2A Q12879 1/20 0.53
GRIN2B Q13224 1/20 0.53
GRIN2C Q14957 1/20 0.53
MAPK1 P28482 1/20 0.51
ALDH1A1 P00352 2/20 0.50
RARB P10826 7/20 0.49
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
RARA P10276 1/20 0.46
MAPT P10636 1/20 0.46
MTOR P42345 1/20 0.46
TAS2R14 Q9NYV8 1/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL104594 0.94 GRIN2D (0.57) GRIN2DGRIN2AGRIN2BGRIN2CMAPK1
SCHEMBL11654726 0.89 RARB (0.62) GRIN2DGRIN2AGRIN2BGRIN2CMAPK1
Dimethylamine SCHEMBL1401396 0.89 GRIN2D (0.53) GRIN2DGRIN2AGRIN2BGRIN2CMAPK1
SCHEMBL24370665 0.84 GRIN2D (0.71) GRIN2DGRIN2AGRIN2BGRIN2CMAPK1
SCHEMBL26298725 0.82 GRIN2D (0.65) GRIN2DGRIN2AGRIN2BGRIN2CMAPK1
SCHEMBL10356173 0.81 GRIN2D (0.63) GRIN2DGRIN2AGRIN2BGRIN2CMAPK1
SCHEMBL10356210 0.81 GRIN2D (0.63) GRIN2DGRIN2AGRIN2BGRIN2CMAPK1
SCHEMBL10356642 0.81 GRIN2D (0.63) GRIN2DGRIN2AGRIN2BGRIN2CMAPK1
SCHEMBL10356640 0.81 GRIN2D (0.63) GRIN2DGRIN2AGRIN2BGRIN2CMAPK1
SCHEMBL14720935 0.80 ALDH1A1 (0.52) GRIN2DGRIN2AGRIN2BGRIN2CMAPK1

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
CN-103649244-A Photocurable inkjet ink and electronic circuit board JNC CORP 2014-03-19 CN disclosed
CN-1834164-A Pigmentation combination SUMITOMO CHEMICAL CO (JP) 2006-09-20 CN disclosed
CN-1221582-C Liquid curable resin composition DSM NV (NL) 2005-10-05 CN disclosed
CN-1067094-C Ink compositions HAYAKAWA RUBBER (JP) 2001-06-13 CN disclosed
CN-1235615-A Liquid curable resin composition DSM NV (NL) 1999-11-17 CN disclosed
CN-1084193-A Ink composite HAYAKAWA RUBBER (JP) 1994-03-23 CN disclosed