SCHEMBL680485

SCHEMBL680485

CNCCCN(C)CCCN

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.54
TDP1 Q9NUW8 1/20 0.46
PRMT3 O60678 1/20 0.40
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
PRMT1 Q99873 1/20 0.40
PRMT8 Q9NR22 1/20 0.40
CYP2C19 P33261 2/20 0.39
CYP2C9 P11712 1/20 0.39
EPHX1 P07099 1/20 0.33
S1PR2 O95136 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
S1PR5 Q9H228 1/20 0.31
CASP2 P42575 2/20 0.31
MEN1 O00255 1/20 0.31
CA12 O43570 1/20 0.31
F13A1 P00488 1/20 0.31
CA2 P00918 1/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL25444826 0.98 CHRM2 (0.52) CHRM2TDP1PRMT3CARM1PRMT6
SCHEMBL23191048 0.93 CHRM2 (0.58) CHRM2TDP1PRMT3CARM1PRMT6
SCHEMBL4021737 0.91 CHRM2 (0.54) CHRM2TDP1PRMT3CARM1PRMT6
SCHEMBL6687880 0.91 CHRM2 (0.48) CHRM2TDP1PRMT3CARM1PRMT6
SCHEMBL1231390 0.87 PRMT3 (0.50) CHRM2TDP1PRMT3CARM1PRMT6
SCHEMBL812040 0.86 CHRM2 (0.50) CHRM2TDP1PRMT3CARM1PRMT6
SCHEMBL10045279 0.85 PRMT3 (0.48) CHRM2TDP1PRMT3CARM1PRMT6
SCHEMBL469832 0.85 PRMT3 (0.48) CHRM2TDP1PRMT3CARM1PRMT6
SCHEMBL16317337 0.85 PRMT3 (0.48) CHRM2TDP1PRMT3CARM1PRMT6
Hydrochloric Acid SCHEMBL15775227 0.85 PRMT3 (0.48) CHRM2TDP1PRMT3CARM1PRMT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512865-B1 ESTERS OF 3-POLYAMINE DERIVATIVES OF BILE ACIDS FOR THE TREATMENT OF INFECTIONS VIRBAC (FR) 2021-05-05 EP disclosed
EP-3512864-B1 AMIDE DERIVATIVES OF SQUALAMINE FOR THE TREATMENT OF INFECTIONS VIRBAC (FR) 2021-01-20 EP disclosed
US-10780101-B2 Amide derivatives of squalamine for the treatment of infections VIRBAC (FR) 2020-09-22 US disclosed
EP-3134409-B1 COMPOUNDS AND USE THEREOF IN THE EXPANSION OF HEMATOPOIETIC STEM CELLS AND/OR HEMATOPOIETIC PROGENITOR CELLS UNIV MONTREAL (CA) 2020-02-12 EP disclosed
US-20190262362-A1 AMIDE DERIVATIVES OF SQUALAMINE FOR THE TREATMENT OF INFECTIONS VIRBAC (FR) 2019-08-29 US disclosed
US-20190255073-A1 ESTERS OF 3-POLYAMINE DERIVATIVES OF BILE ACIDS FOR THE TREATMENT OF INFECTIONS VIRBAC (FR) 2019-08-22 US disclosed
US-10023697-B2 Condensation polymers for antimicrobial applications INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2018-07-17 US disclosed
US-10023697-B2 Condensation polymers for antimicrobial applications INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2018-07-17 US disclosed
WO-2018050815-A1 AMIDE DERIVATIVES OF SQUALAMINE FOR THE TREATMENT OF INFECTIONS VIRBAC (FR) 2018-03-22 WO disclosed
WO-2018050814-A1 ESTERS OF 3-POLYAMINE DERIVATIVES OF BILE ACIDS FOR THE TREATMENT OF INFECTIONS VIRBAC (FR) 2018-03-22 WO disclosed
EP-1322568-A1 SIZING COMPOSITION FOR GLASS YARNS, METHOD USING SAID COMPOSITION AND RESULTING PRODUCTS Saint-Gobain Vetrotex France S.A. (FR) 2003-07-02 EP disclosed
WO-2003048066-A1 SIZING COMPOSITION FOR GLASS YARNS, THE GLASS YARNS THUS OBTAINED AND COMPOSITE MATERIALS COMPRISING SAID YARNS SAINT-GOBAIN VETROTEX FRANCE S.A. (FR) 2003-06-12 WO disclosed
US-6514612-B1 Polymerization and crosslinking of acrylate and amine functionalized compounds and/or polymers; reinforcement composites VETROTEX FRANCE (FR) 2003-02-04 US disclosed
WO-2001087792-A1 SIZING COMPOSITION FOR GLASS YARNS, METHOD USING SAID COMPOSITION AND RESULTING PRODUCTS SAINT-GOBAIN VETROTEX FRANCE S.A. (FR) 2001-11-22 WO disclosed
EP-1042248-A1 GLASS FIBRE COATING COMPOSITION, METHOD USING SAID COMPOSITION AND RESULTING PRODUCT VETROTEX FRANCE (FR) 2000-10-11 EP disclosed
EP-0813505-B1 GLASS YARN SIZING COMPOSITION, METHOD USING SAME AND RESULTING PRODUCTS VETROTEX FRANCE SA (FR) 2000-05-17 EP disclosed
US-5961684-A Sizing composition for glass strands, process using this composition and resulting products VETROTEX FRANCE (FR) 1999-10-05 US disclosed
WO-1999031025-A1 GLASS FIBRE COATING COMPOSITION, METHOD USING SAID COMPOSITION AND RESULTING PRODUCT VETROTEX FRANCE (FR) 1999-06-24 WO disclosed
EP-0813505-A1 GLASS YARN SIZING COMPOSITION, METHOD USING SAME AND RESULTING PRODUCTS VETROTEX FRANCE S.A. (FR) 1997-12-29 EP disclosed
WO-1997025288-A1 GLASS YARN SIZING COMPOSITION, METHOD USING SAME AND RESULTING PRODUCTS VETROTEX FRANCE (FR) 1997-07-17 WO disclosed

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

For each of this compound's patents that has machine-readable text (4 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-20190262362-A1 AMIDE DERIVATIVES OF SQUALAMINE FOR THE TREATMENT OF INFECTIONS SUCNR1, GLRA1, SRR CHRM2 1731/4885TDP1 3901/4885PRMT3 497/4885
US-10023697-B2 Condensation polymers for antimicrobial applications PUF60, PARG, PARN CHRM2 4586/4885TDP1 2628/4885PRMT3 1412/4885
US-20190255073-A1 ESTERS OF 3-POLYAMINE DERIVATIVES OF BILE ACIDS FOR THE TREATMENT OF INFECTIONS GPBAR1, NR1H4, ESRRA CHRM2 2921/4885TDP1 3769/4885PRMT3 165/4885
US-10780101-B2 Amide derivatives of squalamine for the treatment of infections SUCNR1, GLRA1, SRR CHRM2 1731/4885TDP1 3901/4885PRMT3 497/4885

“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.