SCHEMBL5487930

SCHEMBL5487930

CC(O)CN1c2ccccc2N(CC(C)O)c2ccccc21

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.71
PTGS2 P35354 2/20 0.71
KDM4E B2RXH2 3/20 0.48
SLC6A2 P23975 5/20 0.43
DRD3 P35462 6/20 0.43
CYP2D6 P10635 4/20 0.43
CHRM2 P08172 4/20 0.43
HTR1A P08908 4/20 0.43
ADRA2A P08913 4/20 0.43
CHRM1 P11229 4/20 0.43
DRD1 P21728 4/20 0.43
SLC6A4 P31645 4/20 0.43
ADRA1A P35348 4/20 0.43
OPRM1 P35372 4/20 0.43
KCNH2 Q12809 4/20 0.43
LMNA P02545 4/20 0.43
HSD17B10 Q99714 4/20 0.43
DRD2 P14416 3/20 0.43
SLC22A1 O15245 3/20 0.43
ALOX15 P16050 3/20 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
SCHEMBL31298153 0.84 PTGS1 (1.00) PTGS1PTGS2KDM4ESLC6A2DRD3
SCHEMBL7168281 0.84 SLC6A2 (0.64) PTGS1PTGS2KDM4ESLC6A2DRD3
SCHEMBL9396083 0.84 PTGS1 (1.00) PTGS1PTGS2KDM4ESLC6A2DRD3
SCHEMBL4625229 0.76 CES1 (0.61) CHRM1ALDH1A1KMT2ABCHEACHE
SCHEMBL6699242 0.74 ALDH1A1 (0.64) PTGS1PTGS2ALDH1A1MAPTMAPK1
SCHEMBL17280822 0.74 ALDH1A1 (0.64) PTGS1PTGS2ALDH1A1MAPTMAPK1
SCHEMBL3435525 0.74 ALDH1A1 (0.64) PTGS1PTGS2ALDH1A1MAPTMAPK1
SCHEMBL5647712 0.69 ALDH1A1 (0.59) KDM4ESLC6A2CYP2D6LMNAALOX15
SCHEMBL29563547 0.67 CARM1 (0.61) PTGS1PTGS2KDM4EDRD3CYP2D6
SCHEMBL11788371 0.67 BACE1 (0.70) KDM4ECYP2D6LMNAALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070041074-A1 Electricallly-cotrollable film having variable optical and/or energy properties SAINT-GOBAIN GLASS FRANCE (FR) 2007-02-22 US disclosed
EP-1027397-B1 ELECTROCHROME POLYMER SYSTEMS BAYER INNOVATION GMBH (DE) 2006-10-18 EP disclosed
EP-1649320-A1 ELECTRICALLY-CONTROLLABLE FILM HAVING VARIABLE OPTICAL AND/OR ENERGY PROPERTIES SAINT-GOBAIN GLASS FRANCE (FR) 2006-04-26 EP disclosed
WO-2005008326-A1 ELECTRICALLY-CONTROLLABLE FILM HAVING VARIABLE OPTICAL AND/OR ENERGY PROPERTIES SAINT-GOBAIN GLASS FRANCE (FR) 2005-01-27 WO disclosed
US-6569361-B1 Polycondensation or polyaddition of electrochromic monomers are used in devices for variable transparency BAYER AKTIENGESELLSCHAFT (DE) 2003-05-27 US disclosed
EP-1027397-A1 ELECTROCHROME POLYMER SYSTEMS Bayer Aktiengesellschaft (DE) 2000-08-16 EP disclosed
WO-1999002621-A1 ELECTROCHROME POLYMER SYSTEMS BAYER AKTIENGESELLSCHAFT (DE) 1999-01-21 WO disclosed