SCHEMBL8539506

SCHEMBL8539506

COc1cc(OC)nc(N(C(N)=O)S(=O)(=O)Nn2cccc2C(=O)C2CC2)n1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
CHIA Q9BZP6 1/20 0.31
TP53 P04637 1/20 0.30
GLA P06280 1/20 0.30
MAPT P10636 1/20 0.30
CHEK1 O14757 1/20 0.30
JAK2 O60674 1/20 0.30

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
SCHEMBL8540710 0.83 SMN1; SMN2 (0.32) SMN1; SMN2TP53GLAMAPT
SCHEMBL29992711 0.77 SMN1; SMN2 (0.35) SMN1; SMN2CHIATP53GLAMAPT
SCHEMBL1535842 0.77 SMN1; SMN2 (0.35) SMN1; SMN2CHIATP53GLAMAPT
SCHEMBL9247051 0.77 SMN1; SMN2 (0.35) SMN1; SMN2TP53GLAMAPT
SCHEMBL8829615 0.76 GAA (0.45) SMN1; SMN2TP53GLAMAPTJAK2
SCHEMBL6293979 0.73 SMN1; SMN2 (0.40) SMN1; SMN2TP53GLAMAPT
SCHEMBL28716152 0.66 SMN1; SMN2 (0.38) SMN1; SMN2TP53GLAMAPT
SCHEMBL27344040 0.65 MEN1 (0.35) SMN1; SMN2TP53MAPTJAK2
SCHEMBL27704450 0.63 HCRTR1 (0.36) SMN1; SMN2
SCHEMBL8540689 0.62 GAA (0.47) SMN1; SMN2TP53GLAMAPT

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-0648764-B1 N-(substituted amino)pyrrole derivatives, preparation process thereof, and herbicidal compositions KUREHA CHEMICAL IND CO LTD (JP) 1998-12-16 EP disclosed