SCHEMBL11010299

SCHEMBL11010299

C#CCN(C)c1nc(CO)cs1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAOA P21397 2/20 0.31
MAOB P27338 2/20 0.31

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
SCHEMBL11011317 0.84 MEN1 (0.33) MEN1KMT2AMAOAMAOB
SCHEMBL11012978 0.81 MEN1 (0.35) MEN1KMT2A
SCHEMBL7176303 0.77 MEN1 (0.54) MEN1KMT2A
SCHEMBL15348915 0.75 ALDH1A1 (0.44) MEN1KMT2A
SCHEMBL11009272 0.74 OGA (0.32) MEN1KMT2A
SCHEMBL11016584 0.73 MAPT (0.34) MAOAMAOB
SCHEMBL11011001 0.72 MAOA (0.39) MEN1KMT2AMAOA
SCHEMBL7186601 0.70 MEN1 (0.44) MEN1KMT2A
SCHEMBL18674680 0.67 MEN1 (0.41) MEN1KMT2A
SCHEMBL9265009 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4535088-A FUNGICIDES SHIONOGI & CO., LTD. (JP) 1985-08-13 US disclosed
EP-0111904-A2 Propynylaminothiazole derivatives SHIONOGI & CO., LTD. (JP) 1984-06-27 EP disclosed