SCHEMBL9505937

SCHEMBL9505937

[CH2]CCCC(=O)NCCCN

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 2/20 0.46
TSHR P16473 2/20 0.42
PAOX Q6QHF9 3/20 0.41
KDM4A O75164 1/20 0.40
HIF1A Q16665 1/20 0.40
TET2 Q6N021 1/20 0.40
DOHH Q9BU89 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CASP2 P42575 1/20 0.39
FAAH O00519 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 1/20 0.38
NAAA Q02083 1/20 0.37

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
SCHEMBL9508493 0.94 SLC6A5 (0.53) SLC6A5TSHRPAOXKDM4AHIF1A
SCHEMBL2403510 0.92 SLC6A5 (0.55) SLC6A5TSHRPAOXKDM4AHIF1A
SCHEMBL28520891 0.89 SLC6A5 (0.40) SLC6A5TSHRCA1CA2CASP2
SCHEMBL3893572 0.88 SLC6A5 (0.55) SLC6A5TSHRPAOXKDM4AHIF1A
SCHEMBL24761185 0.87 SLC6A5 (0.51) SLC6A5TSHRPAOXKDM4AHIF1A
SCHEMBL6745339 0.87 TSHR (0.54) SLC6A5TSHRPAOXKDM4AHIF1A
SCHEMBL6745342 0.87 TSHR (0.54) SLC6A5TSHRPAOXKDM4AHIF1A
SCHEMBL15058466 0.86 SLC6A5 (0.58) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL9506604 0.85 SLC6A5 (0.59) SLC6A5TSHRPAOXKDM4AHIF1A
SCHEMBL27176325 0.84 SLC6A5 (0.49) SLC6A5TSHRPAOXKDM4AHIF1A

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
EP-0434354-B1 SEPARATION MATERIAL FOR BLOOD COAGULATION FACTOR, PREPARATION AND USE THEREOF KURITA WATER INDUSTRIES LTD. (JP) 1993-08-11 EP disclosed
EP-0434354-A1 Separation material for blood coagulation factor, preparation and use thereof KURITA WATER INDUSTRIES LTD. (JP) 1991-06-26 EP disclosed