SCHEMBL414690

SCHEMBL414690

CCCCCC#CC#CCCC(=O)O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 7/20 0.81
PTPN7 P35236 5/20 0.81
EPHX2 P34913 2/20 0.64
RECQL P46063 2/20 0.63
TDP1 Q9NUW8 2/20 0.63
ALDH1A1 P00352 2/20 0.63
KDM4E B2RXH2 1/20 0.63
MEN1 O00255 1/20 0.63
USP2 O75604 1/20 0.63
POLB P06746 1/20 0.63
MAPT P10636 1/20 0.63
HPGD P15428 1/20 0.63
ALOX12 P18054 1/20 0.63
BLM P54132 1/20 0.63
KMT2A Q03164 1/20 0.63
MCL1 Q07820 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
AKR1B1 P15121 1/20 0.54
TSHR P16473 1/20 0.52
SLC22A6 Q4U2R8 1/20 0.52

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
SCHEMBL417123 0.98 HMGCR (0.85) HMGCRPTPN7EPHX2RECQLTDP1
SCHEMBL26624505 0.98 HMGCR (0.85) HMGCRPTPN7EPHX2RECQLTDP1
SCHEMBL10947728 0.98 HMGCR (0.85) HMGCRPTPN7EPHX2RECQLTDP1
SCHEMBL6661815 0.98 HMGCR (0.85) HMGCRPTPN7EPHX2RECQLTDP1
SCHEMBL20838861 0.98 HMGCR (0.85) HMGCRPTPN7EPHX2RECQLTDP1
SCHEMBL30035957 0.98 HMGCR (0.85) HMGCRPTPN7EPHX2RECQLTDP1
SCHEMBL31510841 0.96 HMGCR (0.76) HMGCRPTPN7EPHX2RECQLTDP1
SCHEMBL31510843 0.94 HMGCR (0.79) HMGCRPTPN7EPHX2RECQLTDP1
SCHEMBL30629431 0.94 HMGCR (0.78) HMGCRPTPN7EPHX2RECQLTDP1
SCHEMBL848674 0.91 PTPN7 (0.80) HMGCRPTPN7EPHX2RECQLTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11441047-B2 Color changing ink jet ink with tunable transition stimuli XEROX CORPORATION (US) 2022-09-13 US claimed
US-20200199392-A1 Color Changing Ink Jet Ink With Tunable Transition Stimuli XEROX CORPORATION 2020-06-25 US claimed
EP-3670616-A1 COLOR CHANGING INK JET INK WITH TUNABLE TRANSITION STIMULI Xerox Corporation (US) 2020-06-24 EP claimed
US-9163307-B2 Three-dimensional photoresists via functionalization of polymer thin films fabricated by iCVD MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-10-20 US claimed
US-20130260054-A1 Three-Dimensional Photoresists via Functionalization of Polymer Thin Films Fabricated by iCVD MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-10-03 US claimed
WO-2013148126-A1 THREE-DIMENSIONAL PHOTORESISTS VIA FUNCTIONALIZATION OF POLYMER THIN FILMS FABRICATED BY ICVD MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-10-03 WO claimed
US-11827800-B2 Color-changing particulate compositions for additive manufacturing and methods associated therewith XEROX CORPORATION (US) 2023-11-28 US disclosed
US-20220403199-A1 COLOR-CHANGING PARTICULATE COMPOSITIONS FOR ADDITIVE MANUFACTURING AND METHODS ASSOCIATED THEREWITH XEROX CORPORATION (US) 2022-12-22 US disclosed
US-11504991-B2 Inkless printing on substrates and comestibles INTERCONTINENTAL GREAT BRANDS LLC (US) 2022-11-22 US disclosed
US-11453796-B2 Color-changing particulate compositions for additive manufacturing and methods associated therewith XEROX CORPORATION (US) 2022-09-27 US disclosed
US-11441047-B2 Color changing ink jet ink with tunable transition stimuli XEROX CORPORATION (US) 2022-09-13 US disclosed
EP-3992234-A1 COLOR-CHANGING PARTICULATE COMPOSITIONS FOR ADDITIVE MANUFACTURING AND METHODS ASSOCIATED THEREWITH Xerox Corporation (US) 2022-05-04 EP disclosed
US-20220127480-A1 COLOR-CHANGING PARTICULATE COMPOSITIONS FOR ADDITIVE MANUFACTURING AND METHODS ASSOCIATED THEREWITH XEROX CORPORATION (US) 2022-04-28 US disclosed
WO-2010029331-A2 COLOUR FORMING COMPOSITION DATALASE LTD. (GB) 2010-03-18 WO disclosed
WO-2010026408-A2 LASER IMAGEABLE PAPER DATALASE LTD. (GB) 2010-03-11 WO disclosed
WO-2010001172-A1 FILTERS DATALASE LTD (GB) 2010-01-07 WO disclosed
US-20090191480-A1 THERMOPLASTIC MATERIAL COMPRISING POLYCHROMIC SUBSTANCES DATALASE LTD (GB) 2009-07-30 US disclosed
WO-2009093028-A2 POLYCHROMIC SUBSTANCES AND THEIR USE DATALASE LTD. (GB) 2009-07-30 WO disclosed
EP-2082890-A1 Thermoplastic material comprising polychromic substances The Procter and Gamble Company (US) 2009-07-29 EP disclosed
WO-2009081385-A2 THERMOPLASTIC MATERIAL COMPRISING POLYCHROMIC SUBSTANCES THE PROCTER & GAMBLE COMPANY (US) 2009-07-02 WO disclosed