SCHEMBL542764

SCHEMBL542764

CCCCc1ccc(OC(c2ccc(CCCC)cc2CCCC)C(CO)(CO)CO)c(CCCC)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.38
MAPT P10636 3/20 0.38
MAPK1 P28482 2/20 0.38
APAF1 O14727 2/20 0.38
THRB P10828 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
RAD52 P43351 2/20 0.37
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
BLM P54132 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
S1PR1 P21453 5/20 0.35
S1PR3 Q99500 2/20 0.35

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
SCHEMBL28602349 0.96 HTT (0.42) HTTMAPTMAPK1APAF1THRB
SCHEMBL9640517 0.95 HTT (0.41) HTTMAPTMAPK1APAF1THRB
Pyrophosphoric Acid SCHEMBL472731 0.91 S1PR1 (0.40) HTTMAPTMAPK1APAF1THRB
SCHEMBL5014104 0.90 GABRA1 (0.40) PPARA
SCHEMBL5013003 0.86 FUT7 (0.34) HTTMAPTMAPK1APAF1THRB
SCHEMBL472730 0.84 S1PR1 (0.41) S1PR1S1PR3S1PR2S1PR4S1PR5
SCHEMBL28071027 0.79 SKP2 (0.37) HTTMAPK1NPC1SMN1; SMN2NPSR1
SCHEMBL997214 0.76 S1PR1 (0.40) S1PR1S1PR3S1PR2S1PR4S1PR5
SCHEMBL28762329 0.75 S1PR1 (0.35) HTTMAPK1NPC1SMN1; SMN2NPSR1
SCHEMBL5014115 0.74 GABRA1 (0.44) L3MBTL1ALDH1A1

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4305866-A HEAT RESISTANT BORG-WARNER CHEMICALS, INC. (US) 1981-12-15 US claimed
EP-4032954-B1 BIOPOLYMER COMPOSITION, PREPARATION METHOD FOR SAME AND BIOPLASTIC USING SAME LG CHEMICAL LTD (KR) 2024-02-07 EP disclosed
CN-110557947-B Quinophthalone compound, photosensitive resin composition containing same, photosensitive material, color filter, and display device 株式会社LG化学 2022-06-14 CN disclosed
CN-111032713-B Binder resin, photosensitive resin composition, photosensitive material, color filter, and display device 株式会社LG化学 2021-12-10 CN disclosed
CN-110392717-B Xanthene compound, colorant composition, photosensitive resin composition, photosensitive material, color filter, and display device 株式会社LG化学 2021-08-27 CN disclosed
CN-107759557-B Compound, colorant composition containing the same, and resin composition containing the same 株式会社LG化学 2021-08-27 CN disclosed
CN-107743487-B Xanthene compound and photosensitive resin composition containing same 株式会社LG化学 2021-08-20 CN disclosed
CN-112204466-A Photosensitive resin composition, photosensitive material, color filter and display device 株式会社LG化学 2021-01-08 CN disclosed
CN-112204465-A Photosensitive resin composition, photosensitive material, color filter and display device 株式会社LG化学 2021-01-08 CN disclosed
CN-111971621-A Colorant composition, photosensitive material, color filter and display device 株式会社LG化学 2020-11-20 CN disclosed
WO-2010112602-A1 BRANCHED POLY (HYDROXY ACID) AND PRODUCTION PROCESS THEREOF SOLVAY SA (BE) 2010-10-07 WO disclosed
EP-1947725-A2 Polymer electrolyte composition and fuel cell Sumitomo Chemical Company, Limited (JP) 2008-07-23 EP disclosed
EP-1289041-B1 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL CO (JP) 2008-03-12 EP disclosed
US-20060257706-A1 POLYMER ELECTROLYTE COMPOSITION AND FUEL CELL HIDAKA YASUAKI 2006-11-16 US disclosed
US-20030113605-A1 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-06-19 US disclosed
EP-1289041-A2 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-05 EP disclosed
EP-0444206-B1 SLIPPERY FILM AND PRODUCTION THEREOF IDEMITSU KOSAN CO (JP) 1997-05-14 EP disclosed
US-5476899-A Multistage stretching of syndiotactic styrene polymer compounded with inorganic fine particles IDEMITSU KOSAN CO., LTD. (JP) 1995-12-19 US disclosed
EP-0444206-A1 SLIPPERY FILM AND PRODUCTION THEREOF IDEMITSU KOSAN COMPANY LIMITED (JP) 1991-09-04 EP disclosed
US-4692539-A REACTING PENTAERYTHRITOL DIPHOSPHORYL CHLORIDE WITH AN ALCOHOL OR PHENOL OR SALT THEREOF CIBA-GEIGY CORPORATION (US) 1987-09-08 US disclosed