SCHEMBL31662394

SCHEMBL31662394

CS(=O)(=O)CCCOc1ccc(Oc2cc(C(=O)NN)cc3cncn23)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.35
GAA P10253 1/20 0.34
EGFR P00533 2/20 0.33
ITK Q08881 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
FFAR1 O14842 4/20 0.33
SCN9A Q15858 2/20 0.33
SCN10A Q9Y5Y9 1/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32
MKNK1 Q9BUB5 1/20 0.32
CHEK2 O96017 1/20 0.32
TBXAS1 P24557 1/20 0.32
LMNA P02545 1/20 0.32
STAT3 P40763 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
POLB P06746 1/20 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
SCHEMBL31662628 0.87 KCNH2 (0.36) GAAMEN1KMT2ACHRNB2CHRNB4
SCHEMBL31662623 0.83 MAPT (0.33) GAAMEN1KMT2ASCN9ACHRNB2
SCHEMBL31662272 0.83 KCNH2 (0.37) GAAMEN1KMT2ACHRNB2CHRNB4
SCHEMBL31662464 0.81 MPO (0.41) GAAMEN1KMT2ALMNASMN1; SMN2
SCHEMBL31662398 0.78 BMPR1B (0.34) CYP11B2
SCHEMBL31662594 0.77 MAPT (0.45) GAALMNASMN1; SMN2
SCHEMBL31662459 0.77 TBXAS1 (0.40) GAAKMT2ACHEK2TBXAS1POLB
SCHEMBL31661982 0.75 GPR119 (0.34) CYP11B2FFAR1
SCHEMBL31662366 0.69 CA1 (0.42) CYP11B2GAALMNASMN1; SMN2POLB
SCHEMBL31662424 0.69 PARP10 (0.48) MEN1KMT2A

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-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO disclosed