SCHEMBL545536

SCHEMBL545536

NCCNCCNCCN1CCCCCC1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.75
CA12 O43570 4/20 0.48
CA9 Q16790 4/20 0.48
CA6 P23280 3/20 0.48
CA7 P43166 3/20 0.48
CA14 Q9ULX7 3/20 0.48
CA5B Q9Y2D0 3/20 0.48
CA2 P00918 3/20 0.48
LMNA P02545 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
CA1 P00915 2/20 0.48
CA3 P07451 2/20 0.48
CA4 P22748 2/20 0.48
CA5A P35218 2/20 0.48
ALOX15 P16050 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TP53 P04637 1/20 0.48
CARM1 Q86X55 1/20 0.46
PRMT6 Q96LA8 1/20 0.46
PRMT8 Q9NR22 1/20 0.46

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
SCHEMBL12976324 1.00 ACE2 (0.75) ACE2CA12CA9CA6CA7
SCHEMBL10904240 0.98 ACE2 (0.78) ACE2CA12CA9CA6CA7
SCHEMBL10708182 0.98 ACE2 (0.78) ACE2CA12CA9CA6CA7
SCHEMBL239132 0.98 ACE2 (0.78) ACE2CA12CA9CA6CA7
SCHEMBL3913565 0.96 ACE2 (0.82) ACE2CA12CA9CA6CA7
SCHEMBL8308932 0.89 ACE2 (0.65) ACE2CA12CA9CA6CA7
SCHEMBL2570372 0.89 ACE2 (0.95) ACE2CA12CA9CA6CA7
SCHEMBL5705876 0.87 ACE2 (0.68) ACE2CA12CA9CA6CA7
SCHEMBL8307200 0.87 ACE2 (0.61) ACE2CA12CA9CA6CA7
SCHEMBL1690928 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112745522-B Preparation method of surface-modified electrostatic spinning aerogel, obtained aerogel and application 北京化工大学 2022-08-02 CN claimed
US-20180304191-A1 METHOD FOR THE SELECTIVE REMOVAL OF HYDROGEN SULFIDE BASF SE (DE) 2018-10-25 US claimed
US-7153630-B2 Resist with reduced line edge roughness MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2006-12-26 US claimed
US-20060078820-A1 Resist with reduced line edge roughness MASS INSTITUTE OF TECHNOLOGY (MIT) (US) 2006-04-13 US claimed
US-20030036015-A1 Resist with reduced line edge roughness AIR FORCE, UNITED STATES 2003-02-20 US claimed
WO-2002091084-A2 RESIST WITH REDUCED LINE EDGE ROUGHNESS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2002-11-14 WO claimed
CN-1119868-A Rare earth compounds and their preparation TIMOTHY JOHN LEEDHAM (FR) 1996-04-03 CN claimed
CN-114959712-A Vapor phase corrosion inhibitor and preparation method thereof 中国石油化工股份有限公司 2022-08-30 CN disclosed
CN-112745522-B Preparation method of surface-modified electrostatic spinning aerogel, obtained aerogel and application 北京化工大学 2022-08-02 CN disclosed
US-20220011670-A1 RESIST UNDERLAYER SURFACE MODIFICATION INTERNATIONAL BUSINESS MACHINES CORPORATION 2022-01-13 US disclosed
CN-112745522-A Preparation method of surface-modified electrostatic spinning aerogel, obtained aerogel and application 北京化工大学 2021-05-04 CN disclosed
US-20180304191-A1 METHOD FOR THE SELECTIVE REMOVAL OF HYDROGEN SULFIDE BASF SE (DE) 2018-10-25 US disclosed
EP-2935198-A2 METHOD FOR STABILISING POLYMERISABLE COMPOUNDS BASF SE (DE) 2015-10-28 EP disclosed
US-7423102-B2 Star polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-09 US disclosed
US-7153630-B2 Resist with reduced line edge roughness MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2006-12-26 US disclosed
US-20060078820-A1 Resist with reduced line edge roughness MASS INSTITUTE OF TECHNOLOGY (MIT) (US) 2006-04-13 US disclosed
US-20060014913-A1 Star polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-01-19 US disclosed
US-6936398-B2 Resist with reduced line edge roughness MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2005-08-30 US disclosed
US-20030036015-A1 Resist with reduced line edge roughness AIR FORCE, UNITED STATES 2003-02-20 US disclosed
WO-2002091084-A2 RESIST WITH REDUCED LINE EDGE ROUGHNESS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2002-11-14 WO disclosed