SCHEMBL1790840

SCHEMBL1790840

C(C#CCOc1ccccc1)#CCOc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 2/20 0.53
▸ KCNA3 P22001 1/20 0.50
▸ TAAR1 Q96RJ0 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ ALOX15 P16050 1/20 0.43
▸ LTA4H P09960 2/20 0.41
▸ HTR1B P28222 2/20 0.40
▸ HDAC3 O15379 1/20 0.40
▸ HDAC4 P56524 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC7 Q8WUI4 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ HDAC10 Q969S8 1/20 0.40
▸ HDAC11 Q96DB2 1/20 0.40

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
SCHEMBL9808291 0.90 KCNH2 (0.57) KCNH2KCNA3TAAR1ALDH1A1RECQL
SCHEMBL11864327 0.87 MAOA (0.46) KCNH2CA12CA1CA2CA7
Diphenylether SCHEMBL10632533 0.83 LTA4H (0.57) KCNH2KCNA3CA12CA1CA2
SCHEMBL9338770 0.81 KCNH2 (0.55) KCNH2KCNA3CA12CA1CA2
SCHEMBL11483215 0.81 KCNH2 (0.50) KCNH2KCNA3TAAR1ALDH1A1RECQL
SCHEMBL10571938 0.81 KCNH2 (0.50) KCNH2KCNA3TAAR1ALDH1A1RECQL
SCHEMBL3683548 0.81 KCNH2 (0.50) KCNH2KCNA3TAAR1ALDH1A1RECQL
SCHEMBL1618118 0.81 KCNH2 (0.50) KCNH2KCNA3TAAR1ALDH1A1RECQL
SCHEMBL10246513 0.81 KCNH2 (0.50) KCNH2KCNA3TAAR1ALDH1A1RECQL
SCHEMBL28345910 0.81 CA12 (0.64) KCNH2KCNA3CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4554797-A1 ANTI-COUNTERFEITING LABEL FOR THE AUTHENTICATION OF GOODS Politecnico di Milano (IT) 2025-05-21 — — EP claimed
WO-2024013693-A1 ANTI-COUNTERFEITING LABEL FOR THE AUTHENTICATION OF GOODS POLITECNICO DI MILANO (IT) 2024-01-18 — — WO claimed
EP-4554797-A1 ANTI-COUNTERFEITING LABEL FOR THE AUTHENTICATION OF GOODS Politecnico di Milano (IT) 2025-05-21 — — EP disclosed
WO-2024013693-A1 ANTI-COUNTERFEITING LABEL FOR THE AUTHENTICATION OF GOODS POLITECNICO DI MILANO (IT) 2024-01-18 — — WO disclosed
CN-112759735-A Polyurethane-based hydrogen-absorbing material and preparation method thereof 中国工程物理研究院材料研究所 2021-05-07 — — CN disclosed
EP-2331751-B1 LASER IMAGEABLE PAPER DATALASE LTD (GB) 2017-07-26 — — EP disclosed
US-9017425-B2 Textile colouration DATALASE LTD. (GB) 2015-04-28 — — US disclosed
EP-2332012-B1 ENERGY ACTIVATED COMPOSITIONS DATALASE LTD (GB) 2014-07-09 — — EP disclosed
US-8637114-B2 Laser imageable paper DATALASE LTD (GB) 2014-01-28 — — US disclosed
US-8557510-B2 Colour forming composition DATALASE LTD. (GB) 2013-10-15 — — US disclosed
EP-2329425-B1 MULTI-COLOURED CODES DATALASE LTD (GB) 2013-07-31 — — EP disclosed
US-20110167572-A1 Textile Colouration DATALASE LTD. (GB) 2011-07-14 — — US disclosed
US-20110159268-A1 Energy Activated Compositions DATALASE LTD. (GB) 2011-06-30 — — US disclosed
US-20110155815-A1 MULTI-COLOURED CODES DATALASE LTD. (GB) 2011-06-30 — — US disclosed
US-20110151384-A1 Colour Forming Composition DATALASE LTD. (GB) 2011-06-23 — — US disclosed
US-20110151380-A1 DATA STORAGE MEDIUM DATALASE LTD. (GB) 2011-06-23 — — US disclosed
US-20110122347-A1 FILTERS DATALASE LTD (GB) 2011-05-26 — — US disclosed
US-6291061-B1 Hydrogen gettering packing material, and process for making same THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY 2001-09-18 — — US disclosed
US-4405487-A Combination moisture and hydrogen getter UNITED STATES OF AMERICA, AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY 1983-09-20 — — US disclosed
US-3963826-A Low temperature, low pressure hydrogen gettering THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES ENERGY RESEARCH AND DEVELOPMENT ADMINISTRATION (US) 1976-06-15 — — US disclosed
Send feedback