SCHEMBL631018

SCHEMBL631018

O=C(O)CCCC#CC#CCCCC(=O)O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 5/20 0.72
HMGCR P04035 7/20 0.65
RECQL P46063 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
MAPT P10636 2/20 0.54
KDM4E B2RXH2 1/20 0.54
MEN1 O00255 1/20 0.54
USP2 O75604 1/20 0.54
ALDH1A1 P00352 1/20 0.54
POLB P06746 1/20 0.54
HPGD P15428 1/20 0.54
ALOX12 P18054 1/20 0.54
BLM P54132 1/20 0.54
KMT2A Q03164 1/20 0.54
MCL1 Q07820 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
LMNA P02545 2/20 0.53
SLC22A6 Q4U2R8 1/20 0.53
TSHR P16473 1/20 0.50
NFKB1 P19838 1/20 0.50

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
SCHEMBL18191268 0.97 PTPN7 (0.69) PTPN7HMGCRRECQLTDP1MAPT
Hydrochloric Acid SCHEMBL8451997 0.97 PTPN7 (0.69) PTPN7HMGCRRECQLTDP1MAPT
SCHEMBL412380 0.93 HMGCR (0.77) PTPN7HMGCRRECQLTDP1MAPT
SCHEMBL6034526 0.93 HMGCR (0.77) PTPN7HMGCRRECQLTDP1MAPT
SCHEMBL416998 0.92 HMGCR (0.76) PTPN7HMGCRRECQLTDP1MAPT
SCHEMBL8763744 0.90 HMGCR (0.80) PTPN7HMGCRRECQLTDP1MAPT
SCHEMBL416646 0.90 HMGCR (0.80) PTPN7HMGCRRECQLTDP1MAPT
SCHEMBL411385 0.90 HMGCR (0.80) PTPN7HMGCRRECQLTDP1MAPT
SCHEMBL11139452 0.90 HMGCR (0.80) PTPN7HMGCRRECQLTDP1MAPT
SCHEMBL414271 0.90 HMGCR (0.80) PTPN7HMGCRRECQLTDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-2678742-B1 REVERSIBLY ACTIVATABLE DIACETYLENES AND THEIR USE AS COLOUR-FORMERS DATALASE LTD (GB) 2018-08-29 EP disclosed
EP-2331751-B1 LASER IMAGEABLE PAPER DATALASE LTD (GB) 2017-07-26 EP disclosed
US-9163307-B2 Three-dimensional photoresists via functionalization of polymer thin films fabricated by iCVD MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-10-20 US disclosed
US-9017425-B2 Textile colouration DATALASE LTD. (GB) 2015-04-28 US disclosed
CN-102144064-B Laser imageable paper DATALASE LTD 2014-09-17 CN disclosed
EP-2332012-B1 ENERGY ACTIVATED COMPOSITIONS DATALASE LTD (GB) 2014-07-09 EP disclosed
US-20140127429-A1 REVERSIBLY ACTIVATABLE DIACETYLENES AND THEIR USE AS COLOUR-FORMERS DATALASE LTD. (UK) 2014-05-08 US disclosed
US-8637114-B2 Laser imageable paper DATALASE LTD (GB) 2014-01-28 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
WO-2009093028-A2 POLYCHROMIC SUBSTANCES AND THEIR USE DATALASE LTD. (GB) 2009-07-30 WO disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO disclosed
US-4550150-A COLORIMETRIC DETECTION ALLIED CORPORATION (US) 1985-10-29 US disclosed
EP-0042069-B1 METAL SALTS OF POLYACETYLENIC COMPOUNDS AND USES THEREOF ALLIED CORPORATION (US) 1985-02-06 EP disclosed
US-4373032-A Metal salts of polyacetylenic compounds and uses thereof as ion exchange and thermochromic polymers ALLIED CORPORATION (US) 1983-02-08 US disclosed