SCHEMBL6540293

SCHEMBL6540293

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nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44

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
SCHEMBL6540289 0.77 PPARD (0.34) TSHR
SCHEMBL30616079 0.74 TSHR (0.52) TSHR
SCHEMBL22720593 0.74 TSHR (0.61) TSHR
SCHEMBL35436 0.73
SCHEMBL3974885 0.73 KMT2A (0.30) TSHR
SCHEMBL9891058 0.72 TSHR (0.43) TSHR
SCHEMBL346640 0.70
SCHEMBL20539620 0.70
Methane SCHEMBL14562663 0.70
Ethane SCHEMBL1199897 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1408980-A4 NOVEL QUINAZOLINES AND USES THEREOF ARIAD PHARMA INC (US) 2004-10-20 EP disclosed
EP-1408980-A2 NOVEL QUINAZOLINES AND USES THEREOF ARIAD PHARMACEUTICALS, INC. (US) 2004-04-21 EP disclosed
WO-2003000188-A2 NOVEL QUINAZOLINES AND USES THEREOF ARIAD PHARMACEUTICALS, INC. (US) 2003-01-03 WO disclosed