SCHEMBL4257136

SCHEMBL4257136

CCCCOCC1COc2cscc2O1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 4/20 0.44
TDP1 Q9NUW8 1/20 0.44
S1PR1 P21453 2/20 0.42
SGPL1 O95470 1/20 0.42
TSHR P16473 3/20 0.36
CYP2D6 P10635 2/20 0.34
RECQL P46063 1/20 0.34
POLB P06746 2/20 0.33
ESR2 Q92731 1/20 0.33
CYP3A4 P08684 1/20 0.33
USP2 O75604 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL4263623 0.96 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1TDP1S1PR1SGPL1
SCHEMBL4263589 0.94 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1TDP1S1PR1SGPL1
SCHEMBL4257286 0.94 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1TDP1S1PR1SGPL1
SCHEMBL4269346 0.94 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1TDP1S1PR1SGPL1
SCHEMBL4258515 0.94 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1TDP1S1PR1SGPL1
SCHEMBL29829574 0.94 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1TDP1S1PR1SGPL1
SCHEMBL4257289 0.91 ALDH1A1 (0.39) SMN1; SMN2ALDH1A1TDP1S1PR1SGPL1
SCHEMBL13321811 0.89 ALDH1A1 (0.37) SMN1; SMN2ALDH1A1TDP1S1PR1SGPL1
SCHEMBL13701399 0.87 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1TDP1S1PR1SGPL1
SCHEMBL24775081 0.87 TSHR (0.41) SMN1; SMN2ALDH1A1TDP1S1PR1SGPL1

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
CN-110140187-B Electrolyte comprising 3,4-ethylenedioxythiophene, electrolytic capacitor comprising the same, and raw material for electronic material 株式会社东进世美肯 2021-11-26 CN disclosed
US-8576543-B2 Solid electrolytic capacitor containing a poly(3,4-ethylenedioxythiophene) quaternary onium salt AVX CORPORATION (US) 2013-11-05 US disclosed
US-20120147529-A1 Solid Electrolytic Capacitor Containing a Poly(3,4-Ethylenedioxythiophene) Quaternary Onium Salt AVX CORPORATION (US) 2012-06-14 US disclosed
EP-1327645-B1 Process for the production of neutral poly(ethylenedioxythiophene) and related poly(ethylenedioxythiophenes) STARCK H C GMBH (DE) 2009-10-21 EP disclosed
US-6756473-B2 REACTING WITH OXIDIZER; APPLYING TO SUBSTRATE BAYER AKTIENGESELLSCHAFT (DE) 2004-06-29 US disclosed
US-20030139505-A1 Process for the preparation of neutral polyethylenedioxythiophene, and corresponding polyethylenedioxythiophenes HERAEUS PRECIOUS METALS GMBH & CO. KG (DE) 2003-07-24 US disclosed
EP-1327645-A1 Process for the production of neutral poly(ethylenedioxythiophene) and related poly(ethylenedioxythiophenes) Bayer Aktiengesellschaft (DE) 2003-07-16 EP disclosed