SCHEMBL1033070

SCHEMBL1033070

C=C(C(=O)OCCCCN)C(CC)CC

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
CPB2 Q96IY4 3/20 0.38
HTR2C P28335 1/20 0.36
CYP1A2 P05177 1/20 0.35
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
THRB P10828 1/20 0.33
NAAA Q02083 1/20 0.32
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
RAD52 P43351 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HPGD P15428 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PAOX Q6QHF9 1/20 0.31

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
SCHEMBL5052486 0.98 TSHR (0.46) TSHRCPB2HTR2CCYP1A2CA1
SCHEMBL19207247 0.98 TSHR (0.46) TSHRCPB2HTR2CCYP1A2CA1
SCHEMBL11762987 0.98 TSHR (0.46) TSHRCPB2HTR2CCYP1A2CA1
SCHEMBL19207301 0.98 TSHR (0.46) TSHRCPB2HTR2CCYP1A2CA1
SCHEMBL19207245 0.98 TSHR (0.46) TSHRCPB2HTR2CCYP1A2CA1
SCHEMBL1031463 0.95 TSHR (0.41) TSHRCPB2HTR2CCYP1A2CA1
SCHEMBL124310 0.87 THRB (0.36) TSHRCPB2CYP1A2CA1CA2
SCHEMBL29117856 0.84 TSHR (0.62) TSHRHTR2CCA1CA2NAAA
SCHEMBL11139716 0.84 TSHR (0.62) TSHRHTR2CCA1CA2NAAA
Iodomethane SCHEMBL716674 0.84 THRB (0.34) TSHRCA1CA2THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4213980-A1 AMINE MODIFIED POLYSACCHARIDE URETHANE/UREA MICROCAPSULES Encapsys, LLC (US) 2023-07-26 EP disclosed
WO-2022061103-A1 AMINE MODIFIED POLYSACCHARIDE URETHANE/UREA MICROCAPSULES ENCAPSYS, LLC (US) 2022-03-24 WO disclosed
EP-1765276-B1 SHATTER RESISTANT ENCAPSULATED COLORANTS FOR NATURAL SKIN APPEARANCE BASF SE (DE) 2013-11-06 EP disclosed
EP-2276797-B1 POLYMER ENCAPSULATED COLOURANTS BY SPRAY DRYING BASF SE (DE) 2012-11-21 EP disclosed
US-20120149265-A1 PARTICULATE COMPOSITION BASF SE (DE) 2012-06-14 US disclosed
EP-2449050-A1 PARTICULATE COMPOSITION BASF SE (DE) 2012-05-09 EP disclosed
US-20110147965-A1 POLYMER ENCAPSULATED COLOURANTS BY SPRAY DRYING BASF SE (DE) 2011-06-23 US disclosed
US-7947294-B2 Shatter resistant encapsulated colorants for natural skin appearance BASF SE (DE) 2011-05-24 US disclosed
EP-2276797-A1 POLYMER ENCAPSULATED COLOURANTS BY SPRAY DRYING BASF SE (DE) 2011-01-26 EP disclosed
WO-2011000688-A1 PARTICULATE COMPOSITION BASF SE (DE) 2011-01-06 WO disclosed
EP-2029090-A1 BLEED-RESISTANT COLORED MICROPARTICLES Ciba Holding Inc. (CH) 2009-03-04 EP disclosed
US-20080281014-A1 Nanosubstance-Containing Composition, Process for Producing the Same, and Composite Made With the Same MITSUBISHI RAYON CO., LTD. (JP) 2008-11-13 US disclosed
US-20070287789-A1 Bleed-resistant colored microparticles CIBA SPECIALTY CHEMICALS CORP. 2007-12-13 US disclosed
WO-2007141742-A2 BLEED-RESISTANT COLORED MICROPARTICLES AND SKIN CARE COMPOSITIONS COMPRISING THEM THE PROCTER & GAMBLE COMPANY (US) 2007-12-13 WO disclosed
WO-2007141169-A1 BLEED-RESISTANT COLORED MICROPARTICLES CIBA HOLDING INC. (CH) 2007-12-13 WO disclosed
US-20070286824-A1 Bleed-resistant colored microparticles and skin care compositions comprising them PROCTER & GAMBLE COMPANY, THE 2007-12-13 US disclosed
EP-1765276-A1 SHATTER RESISTANT ENCAPSULATED COLORANTS FOR NATURAL SKIN APPEARANCE CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2007-03-28 EP disclosed
WO-2005123009-A1 SHATTER RESISTANT ENCAPSULATED COLORANTS FOR NATURAL SKIN APPEARANCE CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2005-12-29 WO disclosed
US-20050276774-A1 Shatter resistant encapsulated colorants for natural skin appearance CIBA CORPORATION 2005-12-15 US disclosed
US-4020216-A Coating composition for flexible substrates E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-04-26 US disclosed