SCHEMBL17090260

SCHEMBL17090260

Cc1cc(NCCCCCNS(=O)(=O)C(C)(C)C)c(C)c2c1OCO2

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GUCY1A1 Q02108 1/20 0.30
GUCY1B1 Q02153 1/20 0.30

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
SCHEMBL13565178 0.85
SCHEMBL10114850 0.83 ALDH1A1 (0.39)
SCHEMBL13566015 0.82 HDAC3 (0.36)
SCHEMBL11935410 0.78 KAT2B (0.35)
SCHEMBL11935624 0.78 BCHE (0.32) GUCY1A1GUCY1B1
SCHEMBL11935638 0.75 ADRA2A (0.39)
SCHEMBL10115085 0.74 ATM (0.33)
SCHEMBL11935639 0.71 NPY5R (0.32)
SCHEMBL13564772 0.71 MAPT (0.49)
SCHEMBL13565156 0.71 GRIA1 (0.32)

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-9139518-B2 Amine derivative having NPY Y5 receptor antagonistic activity SHIONOGI & CO., LTD. (JP) 2015-09-22 US disclosed