SCHEMBL30989772

SCHEMBL30989772

CC(c1cccc(F)c1)N(C)C(=O)c1cc(Cl)cnc1OC(F)F

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 10/20 0.43
▸ PTGER2 P43116 2/20 0.43
▸ SLC6A4 P31645 1/20 0.37
▸ SCN9A Q15858 4/20 0.35
▸ OPRM1 P35372 2/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ OPRL1 P41146 1/20 0.34

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
SCHEMBL30989968 0.91 HPGD (0.34) PTGER4PTGER2MAPK1
SCHEMBL30989829 0.91 HPGD (0.34) PTGER4PTGER2MAPK1
SCHEMBL30990044 0.80 MAPK1 (0.41) PTGER4PTGER2MAPK1
SCHEMBL30989873 0.80 MAPK1 (0.41) PTGER4PTGER2MAPK1
SCHEMBL30989923 0.80 ALDH1A1 (0.47) PTGER4PTGER2
SCHEMBL30843152 0.74 GPBAR1 (0.38) PTGER4PTGER2SCN9A
SCHEMBL30989874 0.74 MEN1 (0.36) PTGER4MAPK1
SCHEMBL30989872 0.74 MEN1 (0.36) PTGER4MAPK1
SCHEMBL30989808 0.72 HTT (0.39) PTGER4PTGER2SCN9A
SCHEMBL30990036 0.69 MAPT (0.36) PTGER4PTGER2SCN9A

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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