SCHEMBL7844220

SCHEMBL7844220

NCCCNC(=O)CCCC(=O)NCCCCCCO

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.52
SLC6A5 Q9Y345 2/20 0.51
PAOX Q6QHF9 3/20 0.47
CNR1 P21554 1/20 0.46
CASP2 P42575 1/20 0.46
KDM4A O75164 1/20 0.44
HIF1A Q16665 1/20 0.44
TET2 Q6N021 1/20 0.44
DOHH Q9BU89 1/20 0.44
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
DNM1 Q05193 1/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL30406271 0.94 SLC6A5 (0.53) NAAASLC6A5PAOXCNR1CASP2
SCHEMBL10795093 0.94 SLC6A5 (0.53) NAAASLC6A5PAOXCNR1CASP2
SCHEMBL10953207 0.92 SLC6A5 (0.59) NAAASLC6A5PAOXCNR1CASP2
SCHEMBL17230156 0.92 SLC6A5 (0.50) NAAASLC6A5PAOXCNR1TSHR
SCHEMBL16306538 0.90 SLC6A5 (0.57) NAAASLC6A5PAOXCNR1CASP2
SCHEMBL10594732 0.90 SLC6A5 (0.47) NAAASLC6A5PAOXCNR1CASP2
SCHEMBL6745342 0.88 TSHR (0.54) SLC6A5PAOXCASP2KDM4AHIF1A
SCHEMBL6745339 0.88 TSHR (0.54) SLC6A5PAOXCASP2KDM4AHIF1A
SCHEMBL18567204 0.86 SLC6A5 (0.57) NAAASLC6A5PAOXCNR1CASP2
SCHEMBL26415654 0.86 NAAA (0.53) NAAASLC6A5CNR1CASP2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0718300-B1 Carbodiimide derivative NISSHIN SPINNING (JP) 2001-11-21 EP disclosed
US-5789588-A BIOTIN DERIVATIIVES OF CARBODIIMIDE FOR NUCLEIC ACIDS AND PROTEINS NISSHINBO INDUSTRIES, INC. (JP) 1998-08-04 US disclosed
US-5700935-A LABEL FOR INTRODUCING BIOTIN GROUP INTO NUCLEIC ACID NISSHINBO INDUSTRIES, INC. (JP) 1997-12-23 US disclosed
EP-0718300-A1 Carbodiimide derivative NISSHINBO INDUSTRIES, INC. (JP) 1996-06-26 EP disclosed