SCHEMBL8661679

SCHEMBL8661679

CCCC(NCC)C(N)CCCCCCN

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38
DNM1 Q05193 8/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
EPHX1 P07099 1/20 0.38
SPHK1 Q9NYA1 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 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
Hydrochloric Acid SCHEMBL8643825 0.76 DNM1 (0.35) GNAI3GNAO1GNAI1DNM1MEN1
SCHEMBL11511106 0.76 CYP2D6 (0.40) GNAI3GNAO1GNAI1ALDH1A1EPHX1
SCHEMBL22188164 0.75 DNM1 (0.46) GNAI3GNAO1GNAI1DNM1MEN1
SCHEMBL350373 0.73 DNM1 (0.65) GNAI3GNAO1GNAI1DNM1MEN1
SCHEMBL29230040 0.72 DNM1 (0.44) GNAI3GNAO1GNAI1DNM1MEN1
SCHEMBL22788210 0.72 ALDH1A1 (0.37) DNM1ALDH1A1TSHRSPHK1DPP8
SCHEMBL27753480 0.71 DNM1 (0.42) GNAI3GNAO1GNAI1DNM1MEN1
SCHEMBL23034836 0.70 DNM1 (0.53) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL11207922 0.70 DNM1 (0.53) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL11212697 0.70 DNM1 (0.53) DNM1MEN1KMT2AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5719193-A Method of potentiating cell-mediated immunity utilizing polyamine derivatives MERRELL PHARMACEUTICALS, INC. (US) 1998-02-17 US claimed