SCHEMBL31316873

SCHEMBL31316873

Cc1cn(-c2cccc(S(C)(=O)=O)c2)nc1N

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.46
NR1H2 P55055 11/20 0.41
NR1H3 Q13133 11/20 0.41
CYP2C9 P11712 9/20 0.41
CYP2D6 P10635 7/20 0.41
CYP3A4 P08684 3/20 0.40
DRD2 P14416 2/20 0.40
LMNA P02545 1/20 0.40
GRM5 P41594 1/20 0.39
JAK2 O60674 1/20 0.39
GRM2 Q14416 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
SCHEMBL31316712 0.77 KCNH2 (0.44) KCNH2NR1H2NR1H3CYP2C9CYP2D6
SCHEMBL23320351 0.76 MAPT (0.46) KCNH2NR1H2NR1H3CYP2C9CYP2D6
SCHEMBL11337983 0.74 ADORA1 (0.54) LMNA
SCHEMBL11698430 0.72 ALDH1A1 (0.63) NR1H2NR1H3CYP2C9CYP3A4DRD2
SCHEMBL31316813 0.72 PLK1 (0.41) KCNH2NR1H2NR1H3DRD2LMNA
SCHEMBL15870658 0.71 KMT2A (0.46) KCNH2NR1H2NR1H3CYP2C9CYP2D6
SCHEMBL23320393 0.70 MEN1 (0.40) KCNH2NR1H2NR1H3CYP2C9CYP2D6
SCHEMBL27932944 0.70 KAT6A (0.51) KCNH2DRD2LMNA
SCHEMBL15555952 0.70 JAK2 (0.48) NR1H2NR1H3DRD2LMNAGRM5
SCHEMBL23320573 0.68 NAMPT (0.48) KCNH2NR1H2NR1H3CYP2C9CYP2D6

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4743453-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION Pretzel Therapeutics, Inc. (US) 2026-05-20 EP disclosed
WO-2025015178-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION PRETZEL THERAPEUTICS, INC. (US) 2025-01-16 WO disclosed