SCHEMBL17482142

SCHEMBL17482142

CCC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C#N)CC(C)C#N

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36

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
SCHEMBL820312 1.00 TSHR (0.36) TSHR
SCHEMBL10050936 1.00 TSHR (0.36) TSHR
SCHEMBL14586670 0.95 TSHR (0.39) TSHR
SCHEMBL19912624 0.90 TSHR (0.42) TSHR
SCHEMBL10038490 0.90 TSHR (0.42) TSHR
SCHEMBL17357067 0.90 TSHR (0.42) TSHR
SCHEMBL13036887 0.90 TSHR (0.42) TSHR
SCHEMBL306162 0.87 TSHR (0.43) TSHR
SCHEMBL13186335 0.87 TSHR (0.32) TSHR
SCHEMBL19729650 0.87 TSHR (0.32) 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-20160033868-A1 METHOD FOR PRODUCING A PLANOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2016-02-04 US disclosed