SCHEMBL10073576

SCHEMBL10073576

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nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.45
DPP4 P27487 1/20 0.44
DPP8 Q6V1X1 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
SLC15A1 P46059 1/20 0.34
CTRB1 P17538 5/20 0.33

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
SCHEMBL10072974 1.00 PAX8 (0.45) PAX8DPP4DPP8DPP7SLC15A1
SCHEMBL12251245 1.00 PAX8 (0.45) PAX8DPP4DPP8DPP7SLC15A1
SCHEMBL14151828 0.92 DPP4 (0.50) PAX8DPP4DPP8DPP7SLC15A1
SCHEMBL1036161 0.92 DPP4 (0.50) PAX8DPP4DPP8DPP7SLC15A1
SCHEMBL13857686 0.79 ALDH1A1 (0.32)
SCHEMBL23690961 0.79 DPP4 (0.50) PAX8DPP4DPP8DPP7SLC15A1
SCHEMBL13811929 0.78 DPP4 (0.41) DPP4DPP8DPP7
SCHEMBL14590394 0.78 PAX8 (0.39) PAX8DPP4CTRB1
SCHEMBL23863812 0.77 CTSC (0.33) PAX8
SCHEMBL8695992 0.77 DPP4 (0.48) PAX8DPP4DPP8DPP7CTRB1

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
WO-2012020231-A1 CHEMICAL LIGATION BY RING OPENING OF OXO-THIOMORPHOLINES THE UNIVERSITY OF READING (GB) 2012-02-16 WO disclosed