SCHEMBL4956473

SCHEMBL4956473

C=C(C)C(=O)OCCCOc1ccc(C2(c3ccc(OCCCOC(=O)C(=C)C)c(CC)c3)c3ccccc3-c3ccccc32)cc1CC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.37
POLB P06746 1/20 0.37
APEX1 P27695 1/20 0.37
HTT P42858 1/20 0.37
TSHR P16473 2/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
LTB4R Q15722 3/20 0.36
LTB4R2 Q9NPC1 2/20 0.34
PDK2 Q15119 5/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
MAPK1 P28482 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
ATM Q13315 1/20 0.33
PTPN11 Q06124 1/20 0.32
THRB P10828 1/20 0.32
ALDH1A1 P00352 1/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 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
SCHEMBL4948908 0.95 ESR1 (0.37) TDP1POLBAPEX1HTTTSHR
SCHEMBL6322728 0.93 PPARG (0.39) TDP1POLBAPEX1HTTTSHR
SCHEMBL4955324 0.89 ESR1 (0.38) POLBESR1ESR2PDK2MAPT
SCHEMBL15356213 0.89 TSHR (0.37) TDP1POLBAPEX1HTTTSHR
SCHEMBL6321833 0.88 PPARG (0.36) TSHRESR1ESR2THRBPPARG
SCHEMBL2234170 0.88 ESR1 (0.45) TDP1POLBAPEX1HTTTSHR
SCHEMBL28295187 0.86 ESR1 (0.36) TDP1POLBAPEX1HTTESR1
SCHEMBL2231419 0.86 KDM4E (0.40) TDP1POLBAPEX1HTTESR1
SCHEMBL4953546 0.85 ESR1 (0.42) POLBAPEX1HTTESR1ESR2
SCHEMBL15356210 0.85 POLB (0.39) TDP1POLBAPEX1HTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023188978-A1 CURABLE COMPOSITION, CURED PRODUCT, MOLDED BODY, AND OPTICAL MATERIAL 三井化学株式会社 2023-10-05 WO claimed
WO-2023188978-A1 CURABLE COMPOSITION, CURED PRODUCT, MOLDED BODY, AND OPTICAL MATERIAL 三井化学株式会社 2023-10-05 WO disclosed
WO-2023188968-A1 POLYFUNCTIONAL (METH)ACRYLATE THIOESTER COMPOSITION, CURABLE COMPOSITION, CURED PRODUCT, MOLDED BODY, OPTICAL MATERIAL, AND METHOD FOR PRODUCING POLYFUNCTIONAL (METH)ACRYLATE THIOESTER COMPOSITION 三井化学株式会社 2023-10-05 WO disclosed
US-10611869-B2 Curable composition and cured product AGC Inc. (JP) 2020-04-07 US disclosed
US-20190218325-A1 CURABLE COMPOSITION AND CURED PRODUCT AGC Inc. (JP) 2019-07-18 US disclosed
US-7361432-B2 Composition for hologram-recording material, hologram-recording medium, and process for producing the same NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2008-04-22 US disclosed
US-20050185232-A1 Volume hologram recording photosensitive composition and its use NIPPON PAINT CO., LTD. (JP) 2005-08-25 US disclosed
US-20040096776-A1 Composition for hologram-recording material, hologram-recording medium, and process for producing the same Daiso, Co., Ltd. (JP) 2004-05-20 US disclosed
EP-1376268-A1 COMPOSITION FOR HOLOGRAM-RECORDING MATERIAL, HOLOGRAM-RECORDING MEDIUM, AND PROCESS FOR PRODUCING THE SAME National Institute of Advanced Industrial Science and Technology (JP) 2004-01-02 EP disclosed
US-20030096172-A1 Hologram recording material composition and hologram recording medium DAISO CO., LTD. (JP) 2003-05-22 US disclosed