SCHEMBL9840679

SCHEMBL9840679

NCCCCCC(N)C(=O)CCN

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.59
GNAI3 P08754 1/20 0.50
GNAO1 P09471 1/20 0.50
GNAI1 P63096 1/20 0.50
DPP7 Q9UHL4 8/20 0.47
DPP8 Q6V1X1 4/20 0.47
DPP9 Q86TI2 4/20 0.47
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
CHRM1 P11229 1/20 0.46
DPP4 P27487 2/20 0.45
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
PLG P00747 1/20 0.43
LMNA P02545 1/20 0.43
THRB P10828 1/20 0.43
ALOX15 P16050 1/20 0.43
SLC6A2 P23975 1/20 0.43
RECQL P46063 1/20 0.43
SLC6A3 Q01959 1/20 0.43

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
SCHEMBL14640487 0.98 GSR (0.61) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL17029472 0.91 GSR (0.59) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL19186295 0.86 CHRM2 (0.54) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL30421734 0.84 GSR (0.52) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL29622881 0.84 LMNA (0.63) GSRGNAI3GNAO1GNAI1CHRM2
SCHEMBL29622843 0.84 LMNA (0.63) GSRGNAI3GNAO1GNAI1CHRM2
SCHEMBL3959872 0.84 LMNA (0.63) GSRGNAI3GNAO1GNAI1CHRM2
SCHEMBL15184957 0.83 GSR (0.55) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL22807654 0.83 GSR (0.55) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL14117682 0.83 GNAI3 (0.56) GSRGNAI3GNAO1GNAI1DPP7

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-5011861-A Containing functional groups capable of bonding peptides and proteins MILLIPORE CORPORATION (US) 1991-04-30 US disclosed
EP-0353460-A2 Membranes for solid phase protein sequencing MILLIPORE CORPORATION (US) 1990-02-07 EP disclosed