SCHEMBL9853992

SCHEMBL9853992

S=C(Nc1ccn2c1CSC2c1cccnc1)c1cccc(Oc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 1/20 0.53
TBXAS1 P24557 2/20 0.40
CFTR P13569 1/20 0.38

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
SCHEMBL9853951 0.90 PTAFR (0.59) PTAFRTBXAS1
SCHEMBL9854002 0.90 PTAFR (0.59) PTAFRTBXAS1
SCHEMBL9853922 0.89 PTAFR (0.56) PTAFRTBXAS1
SCHEMBL9854080 0.87 PTAFR (0.67) PTAFR
SCHEMBL9854055 0.85 PTAFR (0.51) PTAFRTBXAS1
SCHEMBL9853990 0.83 PTAFR (0.49) PTAFRTBXAS1
SCHEMBL9853964 0.83 PTAFR (0.52) PTAFRTBXAS1
SCHEMBL9551679 0.82 PTAFR (0.61) PTAFRTBXAS1
SCHEMBL9853956 0.82 PTAFR (0.53) PTAFRTBXAS1
SCHEMBL9854063 0.80 PTAFR (0.53) PTAFRTBXAS1

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
EP-0425134-A1 Condensed pyrrolo derivatives, process for their preparation and pharmaceutical compositions containing them YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1991-05-02 EP disclosed