SCHEMBL1260101

SCHEMBL1260101

C=C(C)C(=O)OCCCCC(C[N+](C)(C)C)OP(=O)([O-])O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
THRB P10828 1/20 0.34
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
HRH1 P35367 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL1260811 0.99 TSHR (0.44) TSHRPOLBAPEX1HTTTDP1
SCHEMBL5673772 0.99 TSHR (0.44) TSHRPOLBAPEX1HTTTDP1
SCHEMBL31216396 0.96 TSHR (0.40) TSHRPOLBAPEX1HTTTDP1
SCHEMBL80350 0.91 THRB (0.36) TSHRTHRBMEN1CYP1A2HRH1
SCHEMBL541372 0.90 TSHR (0.44) TSHRPOLBAPEX1HTTTDP1
SCHEMBL3976898 0.90 TSHR (0.53) TSHRMEN1KMT2ALMNA
SCHEMBL17964294 0.89 TSHR (0.46) TSHRPOLBAPEX1HTTTDP1
SCHEMBL541106 0.89 TSHR (0.47) TSHRPOLBAPEX1HTTTDP1
SCHEMBL541808 0.89 TSHR (0.47) TSHRPOLBAPEX1HTTTDP1
SCHEMBL28062034 0.89 TSHR (0.47) TSHRPOLBAPEX1HTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022203032-A1 SUBSTRATE FOR IMMOBILIZING SUBSTANCE, AND USE THEREOF 国立研究開発法人理化学研究所 2022-09-29 WO disclosed
WO-2022054743-A1 METHOD FOR FORMING GRAFT LAYER, METHOD FOR PRODUCING COMPOSITE, AND TREATMENT LIQUID FOR FORMING GRAFT LAYER 京セラ株式会社 2022-03-17 WO disclosed
US-20220017714-A1 MEDICAL MEMBER AND METHOD FOR MANUFACTURING SAME KYOCERA CORPORATION (JP) 2022-01-20 US disclosed
WO-2021145298-A1 METHOD FOR PRODUCING ARTIFICIAL JOINT SLIDING MEMBER, ARTIFICIAL JOINT SLIDING MEMBER, AND ARTIFICIAL JOINT 京セラ株式会社 2021-07-22 WO disclosed
EP-3851132-A1 MEDICAL MEMBER AND METHOD FOR MANUFACTURING SAME Kyocera Corporation (JP) 2021-07-21 EP disclosed
WO-2019151478-A1 POLYMER COMPOUND FOR NUCLEIC ACID DELIVERY 国立大学法人東京大学 2019-08-08 WO disclosed
US-9216241-B2 Medical device and method for producing the same KYOCERA MEDICAL CORPORATION (JP) 2015-12-22 US disclosed
US-9192694-B2 Biocompatible and low-abrasion member, and artificial joint using the same and method of producing the same KYOCERA MEDICAL CORPORATION (JP) 2015-11-24 US disclosed
EP-2204197-B1 BIOCOMPATIBLE AND LOW-WEAR MATERIAL, ARTIFICIAL JOINT USING THE SAME AND METHOD OF PRODUCING THE SAME KYOCERA MEDICAL CORP (JP) 2014-12-10 EP disclosed
EP-2233159-B1 MEDICAL DEVICE AND METHOD FOR MANUFACTURE THEREOF KYOCERA MEDICAL CORP (JP) 2014-05-14 EP disclosed
US-20120197413-A1 BIOCOMPATIBLE AND LOW-ABRASION MEMBER, AND ARTIFICIAL JOINT USING THE SAME AND METHOD OF PRODUCING THE SAME KYOCERA CORPORATION (JP) 2012-08-02 US disclosed
US-20110027757-A1 MEDICAL DEVICE AND METHOD FOR PRODUCING THE SAME Japan Medical Materials Corporation and The University of Tokyo 2011-02-03 US disclosed
EP-2233159-A1 MEDICAL DEVICE AND METHOD FOR MANUFACTURE THEREOF Japan Medical Materials Corporation (JP) 2010-09-29 EP disclosed
EP-2204197-A1 BIOCOMPATIBLE AND LOW-WEAR MATERIAL, ARTIFICIAL JOINT USING THE SAME AND METHOD OF PRODUCING THE SAME Japan Medical Materials Corporation (JP) 2010-07-07 EP disclosed
US-20100151188-A1 STRUCTURE HAVING ORGANIC-INORGANIC COMPOSITE LAYER AND METHOD OF MANUFACTURING THE SAME FUJIFILM CORPORATION (JP) 2010-06-17 US disclosed
US-20090239381-A1 POROUS FILM FUJIFILM CORPORATION (JP) 2009-09-24 US disclosed