SCHEMBL21392998

SCHEMBL21392998

C=Cc1ncn([C@H]2CC[C@@H](CNS(=O)(=O)O)C2)c1C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADCY5 O95622 5/20 0.32

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
SCHEMBL21392994 0.62 ADA (0.38) ADCY5
SCHEMBL5633219 0.62
SCHEMBL21393218 0.60 ADCY5 (0.43) ADCY5
SCHEMBL27889792 0.56 KMT2A (0.46)
SCHEMBL21393152 0.56 NAE1 (0.33)
Fluorobenzene SCHEMBL27281603 0.55 GBA1 (0.44)
SCHEMBL2589325 0.54 KMT2A (0.47)
SCHEMBL5418546 0.53 LMNA (0.31)
SCHEMBL12157113 0.53 ADCY5 (0.42) ADCY5
SCHEMBL29425369 0.51 CA2 (0.37)

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-2019180683-A1 STING MODULATOR COMPOUNDS WITH SULFAMATE LINKAGES, AND METHODS OF MAKING AND USING TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-09-26 WO disclosed