SCHEMBL4274867

SCHEMBL4274867

C=CC(=O)NCCCCNC(=N)N

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.58
ZDHHC2 Q9UIJ5 1/20 0.58
ALDH1A1 P00352 2/20 0.46
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALOX15 P16050 1/20 0.44
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TGM2 P21980 9/20 0.42
MAPT P10636 1/20 0.41
GAA P10253 1/20 0.39
ALB P02768 1/20 0.35
FGFR4 P22455 1/20 0.33
SPHK1 Q9NYA1 2/20 0.33

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
SCHEMBL12465059 0.96 ZDHHC20 (0.53) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL30705730 0.92 TSHR (0.50) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
Agmatine SCHEMBL955625 0.88 ALOX15 (0.47) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL632264 0.85 ZDHHC20 (0.75) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL29041295 0.83 ZDHHC20 (0.58) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL28414712 0.83 ZDHHC20 (0.58) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL28424912 0.83 ZDHHC20 (0.58) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL8405507 0.83 ZDHHC20 (0.79) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL1592093 0.83 ZDHHC20 (0.79) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL58169 0.83 ZDHHC20 (0.79) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10017461-B2 Method of making ligand functionalized substrates 3M INNOVATIVE PROPERTIES COMPANY (US) 2018-07-10 US disclosed
US-20170217880-A1 METHOD OF MAKING LIGAND FUNCTIONALIZED SUBSTRATES SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2017-08-03 US disclosed
EP-1923064-B1 Use of amine polymer for lowering serum glucose GENZYME CORP (US) 2017-06-28 EP disclosed
US-9650470-B2 Method of making ligand functionalized substrates 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-05-16 US disclosed
US-20140364519-A1 METHOD OF MAKING LIGAND FUNCTIONALIZED SUBSTRATES SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2014-12-11 US disclosed
EP-1675818-B1 METHOD FOR SYNTHESIS OF ACRYLAMIDO AGMATINE GE HEALTHCARE BIO SCIENCES AB (SE) 2014-12-03 EP disclosed
US-8846203-B2 Method of making ligand functionalized substrates 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-09-30 US disclosed
EP-2522692-B1 Ligand monomers and copolymers made therewith 3M INNOVATIVE PROPERTIES CO (US) 2014-06-18 EP disclosed
US-20140087445-A1 METHOD OF MAKING LIGAND FUNCTIONALIZED SUBSTRATES 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-03-27 US disclosed
US-8652582-B2 Method of making ligand functionalized substrates 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-02-18 US disclosed
WO-2002085380-A1 METHOD FOR TREATING GOUT AND REDUCING SERUM URIC ACID GELTEX PHARMACEUTICALS, INC. (US) 2002-10-31 WO disclosed
US-20010051660-A1 Method for reducing oxalate GELTEX PHARMACEUTICAL, INC. (US) 2001-12-13 US disclosed
US-6281252-B1 ADMINISTERING A ALIPHATIC AMINE POLYMER; THERAPY FOR KIDNEY STONES GELTEX PHARMACEUTICAL, INC. 2001-08-28 US disclosed
US-6177478-B1 USING AN AMINE POLYMER; PREVENT KIDNEY STONES GELTEX PHARMACEUTICALS, INC. 2001-01-23 US disclosed
EP-1044008-A1 USE OF ALIPHATIC POLYAMINES FOR REDUCING OXALATE GELTEX PHARMACEUTICALS, INC. (US) 2000-10-18 EP disclosed
US-5985938-A Method for reducing oxalate GELTEX PHARMACEUTICALS, INC. (US) 1999-11-16 US disclosed
WO-1999022744-A1 USE OF ALIPHATIC POLYAMINES FOR REDUCING OXALATE GELTEX PHARMACEUTICALS, INC. (US) 1999-05-14 WO disclosed
WO-1998042355-A1 PHOSPHATE-BINDING POLYMERS COMBINED WITH A CALCIUM SUPPLEMENT FOR ORAL ADMINISTRATION GELTEX PHARMACEUTICALS, INC. (US) 1998-10-01 WO disclosed
EP-0831857-A2 PHOSPHATE-BINDING POLYMERS FOR ORAL ADMINISTRATION GELTEX PHARMACEUTICALS, INC. (US) 1998-04-01 EP disclosed
WO-1996039156-A2 PHOSPHATE-BINDING POLYMERS FOR ORAL ADMINISTRATION GELTEX PHARMACEUTICALS, INC. (US) 1996-12-12 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 (5 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-10017461-B2 Method of making ligand functionalized substrates SPR, SELPLG, SIGLEC7 ZDHHC20 3224/4885ZDHHC2 3371/4885ALDH1A1 1262/4885
US-20010051660-A1 Method for reducing oxalate OAT, OTC, XDH ZDHHC20 4024/4885ZDHHC2 4250/4885ALDH1A1 2135/4885
US-20140364519-A1 METHOD OF MAKING LIGAND FUNCTIONALIZED SUBSTRATES SPR, SELPLG, SIGLEC7 ZDHHC20 3224/4885ZDHHC2 3371/4885ALDH1A1 1262/4885
US-20170217880-A1 METHOD OF MAKING LIGAND FUNCTIONALIZED SUBSTRATES SPR, SELPLG, SIGLEC7 ZDHHC20 3224/4885ZDHHC2 3371/4885ALDH1A1 1262/4885
US-20140087445-A1 METHOD OF MAKING LIGAND FUNCTIONALIZED SUBSTRATES SPR, SELPLG, SIGLEC7 ZDHHC20 3224/4885ZDHHC2 3371/4885ALDH1A1 1262/4885

“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.