SCHEMBL5321819

SCHEMBL5321819

CCC(C=O)CCCn1ncnc1C#N

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL5325862 0.81 TSHR (0.43) TSHRSMN1; SMN2
SCHEMBL5319667 0.81 TSHR (0.43) TSHRSMN1; SMN2
SCHEMBL5327353 0.80 TSHR (0.42) TSHRSMN1; SMN2
SCHEMBL5321248 0.80 TSHR (0.42) TSHRSMN1; SMN2
SCHEMBL5321764 0.80 TSHR (0.42) TSHRSMN1; SMN2
SCHEMBL5323660 0.78 TSHR (0.41) TSHRSMN1; SMN2
SCHEMBL5324893 0.78 TSHR (0.41) TSHRSMN1; SMN2
SCHEMBL5320140 0.77 TSHR (0.44) TSHRSMN1; SMN2
SCHEMBL5318459 0.77 TSHR (0.40) TSHRSMN1; SMN2
SCHEMBL5326203 0.77 TSHR (0.40) TSHRSMN1; SMN2

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
EP-1859781-A2 Brightening and/or colouring agent with triazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 — — EP disclosed
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