SCHEMBL30989763

SCHEMBL30989763

CN(Cc1cccc(F)c1F)S(=O)(=O)c1cc(F)cnc1OC(F)F

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.36
▸ TRPV4 Q9HBA0 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ MAOA P21397 2/20 0.34
▸ CASP3 P42574 2/20 0.34
▸ BMP1 P13497 1/20 0.32
▸ PIK3CA P42336 2/20 0.32
▸ PIK3R1 P27986 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ SCN9A Q15858 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL30989797 0.83 MAOA (0.43) RIPK1TRPV4MAOACASP3L3MBTL1
SCHEMBL30989816 0.80 L3MBTL1 (0.39) RIPK1TRPV4MAOACASP3L3MBTL1
SCHEMBL30989847 0.80 BMP1 (0.33) TRPV4MAOACASP3BMP1ALDH1A1
SCHEMBL30989787 0.78 GRIN1 (0.37) ALDH1A1HPGDMAOB
SCHEMBL30989870 0.77 RIPK1 (0.43) RIPK1ALDH1A1KMT2A
SCHEMBL30989819 0.74 NAMPT (0.41) RIPK1TRPV4MAOACASP3L3MBTL1
SCHEMBL30989752 0.73 TRPV4 (0.36) TRPV4SCN9A
SCHEMBL30989770 0.73 TRPV4 (0.36) TRPV4SCN9A
SCHEMBL30989789 0.73 KDM4E (0.40) RIPK1TRPV4L3MBTL1ALDH1A1HPGD
SCHEMBL14875425 0.68 MAOA (0.49) RIPK1MAOACASP3ALDH1A1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4612131-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2025-09-10 — — EP claimed
WO-2024095003-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2024-05-10 — — WO claimed
EP-4612131-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2025-09-10 — — EP disclosed
WO-2024095003-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2024-05-10 — — WO disclosed
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