SCHEMBL8700624

SCHEMBL8700624

CCC(O)N(CCN)CCN

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32

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
SCHEMBL2849370 0.79 TSHR (0.32) TSHR
SCHEMBL975264 0.78 FDPS (0.42) TSHR
SCHEMBL6565224 0.76 MAPT (0.36) TSHR
SCHEMBL381408 0.74 MMP1 (0.37) TSHR
SCHEMBL1464011 0.74
SCHEMBL16397973 0.72
SCHEMBL11540857 0.72 TRPV1 (0.31)
SCHEMBL8523714 0.72 DNM1 (0.40) TSHR
SCHEMBL15121451 0.72 MMP1 (0.35) TSHR
SCHEMBL15121410 0.72 MMP1 (0.35) TSHR

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-5760191-A Macrocyclic complexing agents and targeting immunoreagents useful in therapeutic and diagnostic compositions and methods NYCOMED IMAGING AS (NO) 1998-06-02 US disclosed