SCHEMBL9779276

SCHEMBL9779276

C=C(CN(CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.49
ICMT O60725 2/20 0.46
ALB P02768 2/20 0.46
DRD2 P14416 2/20 0.44
OPRM1 P35372 2/20 0.44
DRD3 P35462 2/20 0.44
OPRD1 P41143 2/20 0.44
OPRK1 P41145 2/20 0.44
MAOA P21397 2/20 0.44
MAOB P27338 2/20 0.44
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
NAAA Q02083 1/20 0.41
NPC1 O15118 1/20 0.41
JAK2 O60674 1/20 0.41
RAB9A P51151 1/20 0.41
PAX8 Q06710 1/20 0.41

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
SCHEMBL9779440 1.00 KCNH2 (0.49) KCNH2ICMTALBDRD2OPRM1
SCHEMBL9223831 1.00 KCNH2 (0.49) KCNH2ICMTALBDRD2OPRM1
SCHEMBL9603181 1.00 KCNH2 (0.49) KCNH2ICMTALBDRD2OPRM1
SCHEMBL8415451 0.93 MAOA (0.46) KCNH2DRD2OPRM1DRD3OPRD1
SCHEMBL4691160 0.86 MAOA (0.53) DRD2OPRM1DRD3OPRD1OPRK1
SCHEMBL3448140 0.85 ICMT (0.55) KCNH2ICMTALBDRD2OPRM1
SCHEMBL9779367 0.85 ICMT (0.55) KCNH2ICMTALBDRD2OPRM1
SCHEMBL1336877 0.85 ICMT (0.51) KCNH2ICMTALBDRD2OPRM1
SCHEMBL2953630 0.85 ICMT (0.55) KCNH2ICMTALBDRD2OPRM1
SCHEMBL9779042 0.85 ICMT (0.55) KCNH2ICMTALBDRD2OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-4734351-A DISPERSION OF POLYMER FUJI PHOTO FILM CO., LTD. (JP) 1988-03-29 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