SCHEMBL9854059

SCHEMBL9854059

O=C(Nc1ccn2c1CSC2c1cccnc1)c1cccc(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 1/20 0.58
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TBXAS1 P24557 2/20 0.46
GRM5 P41594 2/20 0.44
KCNMA1 Q12791 1/20 0.43
CSF1R P07333 1/20 0.43
TDP2 O95551 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL9854149 0.90 PTAFR (0.63) PTAFRTBXAS1
SCHEMBL9853918 0.90 PTAFR (0.59) PTAFRTBXAS1
SCHEMBL9853936 0.90 PTAFR (0.61) PTAFRTBXAS1
SCHEMBL9854126 0.89 PTAFR (0.54) PTAFRTBXAS1
SCHEMBL9854014 0.89 PTAFR (0.59) PTAFRTBXAS1
SCHEMBL9854042 0.89 PTAFR (0.58) PTAFRTBXAS1GRM5CSF1R
SCHEMBL9854048 0.89 PTAFR (0.58) PTAFRMEN1KMT2ATBXAS1LMNA
SCHEMBL9853917 0.89 PTAFR (0.58) PTAFRTBXAS1
SCHEMBL9853995 0.89 PTAFR (0.58) PTAFRTBXAS1
SCHEMBL9853955 0.89 PTAFR (0.58) 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