SCHEMBL2197667

SCHEMBL2197667

NCCNC(=O)CCCCCCCCCCC(N)=O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 2/20 0.47
FAAH O00519 4/20 0.46
DNM1 Q05193 2/20 0.43
HDAC3 O15379 2/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC2 Q92769 2/20 0.41
HDAC8 Q9BY41 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
HDAC5 Q9UQL6 1/20 0.41
CASP2 P42575 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
NCOR2 Q9Y618 1/20 0.39

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
SCHEMBL2195042 1.00 SLC6A5 (0.47) SLC6A5FAAHDNM1HDAC3HDAC1
SCHEMBL5892041 0.93 TSHR (0.45) SLC6A5FAAHHDAC3HDAC1HDAC2
SCHEMBL20710352 0.93 SLC6A5 (0.51) SLC6A5FAAHDNM1HDAC3HDAC1
SCHEMBL10057792 0.93 SLC6A5 (0.51) SLC6A5FAAHDNM1HDAC3HDAC1
SCHEMBL14198853 0.91 SLC6A5 (0.49) SLC6A5FAAHDNM1HDAC3HDAC1
SCHEMBL16421586 0.89 SLC6A5 (0.57) SLC6A5FAAHDNM1
SCHEMBL22289072 0.89 SLC6A5 (0.57) SLC6A5FAAHDNM1
SCHEMBL28352481 0.89 FAAH (0.50) SLC6A5FAAHDNM1HDAC3HDAC1
SCHEMBL2217380 0.89 FAAH (0.50) SLC6A5FAAHDNM1HDAC3HDAC1
SCHEMBL19382820 0.88 SLC6A5 (0.61) SLC6A5FAAHDNM1CASP2MAOA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9493583-B2 Anionic polysaccharides functionalized by a hydrophobic acid derivative ADOCIA (FR) 2016-11-15 US disclosed
US-20110172166-A1 Anionic polysaccharides functionalized by a hydrophobic acid derivative ADOCIA (FR) 2011-07-14 US 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 (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-20110172166-A1 Anionic polysaccharides functionalized by a hydrophobic acid derivative ALG1, CD44, FUT6 SLC6A5 1565/4885FAAH 3193/4885DNM1 4329/4885

“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.