SCHEMBL30141523

SCHEMBL30141523

CS(=O)(=O)c1cccc(-c2cc(C(N)=O)[nH]n2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 1/20 0.50
▸ TP53 P04637 1/20 0.47
▸ MAPT P10636 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ CAMKK2 Q96RR4 1/20 0.46
▸ PIM1 P11309 2/20 0.46
▸ GSK3B P49841 2/20 0.46
▸ DYRK1B Q9Y463 2/20 0.46
▸ CHEK1 O14757 1/20 0.46
▸ RET P07949 1/20 0.46
▸ PDGFRB P09619 1/20 0.46
▸ PDGFRA P16234 1/20 0.46
▸ RPS6KA3 P51812 1/20 0.46
▸ LIMK1 P53667 1/20 0.46
▸ CDK5 Q00535 1/20 0.46
▸ TYRO3 Q06418 1/20 0.46
▸ MAPK14 Q16539 1/20 0.46
▸ LRRK2 Q5S007 1/20 0.46
▸ AURKB Q96GD4 1/20 0.46
▸ CLK4 Q9HAZ1 1/20 0.46

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
SCHEMBL27313254 0.85 ALPL (0.50) TP53MAPTSMN1; SMN2PIM1GSK3B
SCHEMBL29444426 0.80 SCN9A (0.57) SCN9ATP53MAPTSMN1; SMN2PIM1
SCHEMBL2789578 0.78 TP53 (0.74) SCN9ATP53MAPTPIM1GSK3B
SCHEMBL2851298 0.77 SCN9A (0.54) SCN9ATP53MAPTSMN1; SMN2PIM1
SCHEMBL18726294 0.77 SCN9A (0.57) SCN9ATP53MAPTSMN1; SMN2PIM1
SCHEMBL18726283 0.77 SCN9A (0.54) SCN9ATP53MAPTSMN1; SMN2PIM1
SCHEMBL17279960 0.77 POLB (0.49) LRRK2GRK6KCNH2
SCHEMBL11982068 0.77 MAPT (0.76) SCN9ATP53MAPTSMN1; SMN2GAA
SCHEMBL3655412 0.75 CAMKK2 (0.55) SMN1; SMN2CAMKK2GAAFLT3
SCHEMBL13710596 0.75 SCN9A (0.55) SCN9ATP53MAPTSMN1; SMN2PIM1

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-4355733-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2024-04-24 — — EP disclosed
WO-2022263498-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2022-12-22 — — WO disclosed
Send feedback