SCHEMBL529596

SCHEMBL529596

CCCCCCCCCc1ccnc(-c2cc(CCCCCCCCC)ccn2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PTGS2 P35354 3/20 0.46
ESR1 P03372 2/20 0.46
ADRA2A P08913 2/20 0.46
ADORA3 P0DMS8 2/20 0.46
TACR2 P21452 2/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HSD17B10 Q99714 2/20 0.46
LMNA P02545 1/20 0.46
SHBG P04278 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
HSPD1 P10809 1/20 0.46
ADRB3 P13945 1/20 0.46
HTR2C P28335 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
SCHEMBL913268 1.00 TDP1 (0.46) TDP1L3MBTL1PTGS2ESR1ADRA2A
SCHEMBL31004368 1.00 TDP1 (0.46) TDP1L3MBTL1PTGS2ESR1ADRA2A
SCHEMBL4863242 1.00 TDP1 (0.46) TDP1L3MBTL1PTGS2ESR1ADRA2A
SCHEMBL913250 1.00 TDP1 (0.46) TDP1L3MBTL1PTGS2ESR1ADRA2A
SCHEMBL11798255 1.00 TDP1 (0.46) TDP1L3MBTL1PTGS2ESR1ADRA2A
SCHEMBL1446914 1.00 TDP1 (0.46) TDP1L3MBTL1PTGS2ESR1ADRA2A
SCHEMBL29427461 1.00 TDP1 (0.46) TDP1L3MBTL1PTGS2ESR1ADRA2A
SCHEMBL7964430 1.00 TDP1 (0.46) TDP1L3MBTL1PTGS2ESR1ADRA2A
SCHEMBL7963811 1.00 TDP1 (0.46) TDP1L3MBTL1PTGS2ESR1ADRA2A
SCHEMBL5079241 1.00 TDP1 (0.46) TDP1L3MBTL1PTGS2ESR1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116023566-A Narrow-distribution bio-based polyitaconate homopolymer and preparation method thereof 北京化工大学 2023-04-28 CN claimed
WO-2021078082-A1 USE OF ZWITTERION OR ZWITTERIONIC POLYMER AS PH BUFFER MATERIAL 南京师范大学 2021-04-29 WO claimed
CN-108025115-B Nanoparticles and method for preparing same 上海氪励铵勤科技发展有限公司 2021-04-20 CN claimed
CN-107921181-B Application of magnetic material in calculus extraction 上海氪励铵勤科技发展有限公司 2021-01-12 CN claimed
CN-107987231-B Anti-mud polycarboxylate superplasticizer and preparation method thereof 江苏苏博特新材料股份有限公司 2020-05-26 CN claimed
CN-107141429-B A kind of modified magnetic nano silica and its application in water-oil separating 苏州科技大学 2019-11-29 CN claimed
CN-110272525-A A kind of nanometer silica line composite material and preparation method and application 安徽大学 2019-09-24 CN claimed
CN-110144158-A A kind of nano combined super-hydrophobic coating material of single polymer and preparation method thereof 安徽大学 2019-08-20 CN claimed
CN-110128604-A A kind of Pickering emulsifier and preparation method thereof and Pickering lotion 安徽大学 2019-08-16 CN claimed
CN-109850871-A A kind of porous carbon nanosheet of N doping and preparation method thereof 安徽大学 2019-06-07 CN claimed
EP-2112671-A1 A dye including an anchoring group in its molecular structure Sony Corporation (JP) 2009-10-28 EP claimed
US-20090256106-A1 PATTERNED PHOTOVOLTAIC CELL MERCK KGAA (DE) 2009-10-15 US claimed
EP-1616929-B1 Use of luminescent ruthenium (II)-type pigments in security documents, the process and device to detect them FAB NAC MONEDA Y TIMBRE ES (ES) 2009-09-16 EP claimed
US-7572396-B2 cis-Ru(4,4'-dicarboxylic acid-2,2'-bipyridyl)(4,4'-dinonyl-2,2'-bipyridyl)(NCS)2 ; an organic solvent comprising a mixture of g-butyrolactone and 1-methoxy-2-propanol KONARKA TECHNOLOGIES, INC. (US) 2009-08-11 US claimed
WO-2009053108-A1 A DYE INCLUDING AN ANCHORING GROUP IN ITS MOLECULAR STRUCTURE SONY CORPORATION (JP) 2009-04-30 WO claimed
EP-2053618-A1 A dye including an anchoring group in its molecular structure Sony Corporation (JP) 2009-04-29 EP claimed
US-20080145526-A1 Luminescent Metal Complexes and Associated Technology BIOTIUM, INC. 2008-06-19 US claimed
US-20060130895-A1 Patterned photovoltaic cell MERCK KGAA (DE) 2006-06-22 US claimed
EP-1672653-A2 Patterned photovoltaic cell Konarka Technologies, Inc. (US) 2006-06-21 EP claimed
EP-1473745-A1 Dye sensitized solar cell ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2004-11-03 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080145526-A1 Luminescent Metal Complexes and Associated Technology CLTA, CLTB, CACYBP TDP1 3244/4885L3MBTL1 562/4885PTGS2 2450/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.