SCHEMBL893424

SCHEMBL893424

CN(CCO)c1nc(Nc2ccccc2)nc(Nc2ccc(C=Cc3ccc(Nc4nc(Nc5ccccc5)nc(N(C)CCO)n4)cc3S(=O)(=O)O)c(S(=O)(=O)O)c2)n1.[NaH].[NaH]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.53
CA2 P00918 4/20 0.53
CA9 Q16790 4/20 0.53
CA12 O43570 3/20 0.53
ENPP2 Q13822 1/20 0.39
ALDH1A1 P00352 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
RECQL P46063 1/20 0.37
MCL1 Q07820 1/20 0.37
KCNH3 Q9ULD8 5/20 0.37
NPY5R Q15761 1/20 0.36
EGFR P00533 1/20 0.36
SNCA P37840 1/20 0.36
RHOA P61586 1/20 0.36
TNNI3 P19429 1/20 0.35
TNNT2 P45379 1/20 0.35
TNNC1 P63316 1/20 0.35
HKDC1 Q2TB90 1/20 0.35
CRHR1 P34998 1/20 0.35
PDE5A O76074 1/20 0.35

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
SCHEMBL11028760 1.00 CA1 (0.53) CA1CA2CA9CA12ENPP2
SCHEMBL7909456 1.00 CA1 (0.53) CA1CA2CA9CA12ENPP2
SCHEMBL30449330 0.99 CA1 (0.53) CA1CA2CA9CA12ENPP2
SCHEMBL789844 0.99 CA1 (0.53) CA1CA2CA9CA12ENPP2
SCHEMBL789843 0.99 CA1 (0.53) CA1CA2CA9CA12ENPP2
SCHEMBL454118 0.98 CA1 (0.55) CA1CA2CA9CA12ENPP2
SCHEMBL31004082 0.98 CA1 (0.55) CA1CA2CA9CA12ENPP2
Potassium SCHEMBL2220697 0.98 CA1 (0.53) CA1CA2CA9CA12ENPP2
SCHEMBL16264742 0.95 CA1 (0.50) CA1CA2CA9CA12ENPP2
SCHEMBL14391279 0.94 CA1 (0.59) CA1CA2CA9CA12ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10947483-B2 Encapsulates PROCTER & GAMBLE INTERNATIONAL OPERATIONS SA (CH) 2021-03-16 US claimed
US-10604728-B2 Encapsulates PROCTER & GAMBLE INTERNATIONAL OPERATIONS SA (CH) 2020-03-31 US claimed
US-20170130172-A1 ENCAPSULATES PROCTER & GAMBLE (US) 2017-05-11 US claimed
US-20160304817-A1 ENCAPSULATES PROCTER & GAMBLE (US) 2016-10-20 US claimed
US-20160130537-A1 ENCAPSULATES PROCTER & GAMBLE (US) 2016-05-12 US claimed
EP-2999776-A2 ENCAPSULATES The Procter & Gamble Company (US) 2016-03-30 EP claimed
WO-2014189980-A1 ENCAPSULATES PGIOSA (CH) 2014-11-27 WO claimed
WO-2014189906-A2 ENCAPSULATES THE PROCTER & GAMBLE COMPANY (US) 2014-11-27 WO claimed
EP-2806018-A1 ENCAPSULATES The Procter & Gamble Company (US) 2014-11-26 EP claimed
US-20140342972-A1 ENCAPSULATES THE PROCTER & GAMBLE COMPANY (US) 2014-11-20 US claimed
EP-1555009-B1 Skin make-up composition OREAL (FR) 2010-07-14 EP claimed
EP-2126017-A1 LIQUID LAUNDRY DETERGENT COMPOSITIONS COMPRISING PERFORMANCE BOOSTERS The Procter and Gamble Company (US) 2009-12-02 EP claimed
US-20080234165-A1 Liquid laundry detergent compositions comprising performance boosters PROCTER & GAMBLE COMPANY, THE 2008-09-25 US claimed
WO-2008114171-A1 LIQUID LAUNDRY DETERGENT COMPOSITIONS COMPRISING PERFORMANCE BOOSTERS THE PROCTER & GAMBLE COMPANY (US) 2008-09-25 WO claimed
US-20080184495-A1 Dye composition comprising a reactive silicone and a fluorescent dye, and dyeing process using the composition L'OREAL S.A. (FR) 2008-08-07 US claimed
EP-1807496-A1 FABRIC CARE COMPOSITIONS COMPRISING HUEING DYE The Procter and Gamble Company (US) 2007-07-18 EP claimed
US-7235518-B2 Fabric care compositions comprising hueing dye THE PROCTER & GAMBLE COMPANY (US) 2007-06-26 US claimed
WO-2006041954-A1 FABRIC CARE COMPOSITIONS COMPRISING HUEING DYE THE PROCTER & GAMBLE COMPANY (US) 2006-04-20 WO claimed
US-20060079438-A1 Fabric care compositions comprising hueing dye PROCTER & GAMBLE COMPANY, THE 2006-04-13 US claimed
US-20050031559-A1 Mineral particles containing optical brightener for lightening the face skin; mixture of silica, hydroxyapatite particles and dyes of stilbene, or coumarin; foundation powders with concealing properties L'OREAL (FR) 2005-02-10 US 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 (2 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-20080184495-A1 Dye composition comprising a reactive silicone and a fluorescent dye, and dyeing process using the composition KRT18, VIM, CD44 CA1 1828/4885CA2 2651/4885CA9 873/4885
US-10947483-B2 Encapsulates LIPA, TTPA, CHMP4B CA1 3244/4885CA2 3928/4885CA9 2229/4885

“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.