SCHEMBL29643192

SCHEMBL29643192

NC(=O)c1cnc2c(-c3cc(F)cc(F)c3F)cccc2c1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PSMD14 O00487 4/20 0.53
▸ STAMBP O95630 3/20 0.53
▸ COPS5 Q92905 3/20 0.53
▸ HPGDS O60760 3/20 0.43
▸ PARP1 P09874 9/20 0.39
▸ CHEK2 O96017 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ MAPK14 Q16539 1/20 0.36

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
SCHEMBL30241001 0.89 PSMD14 (0.52) PSMD14STAMBPCOPS5HPGDSMAPK14
SCHEMBL29643179 0.82 PSMD14 (0.44) PSMD14STAMBPCOPS5HPGDSPARP1
SCHEMBL30241100 0.80 CYP17A1 (0.34) NPC1
SCHEMBL29688144 0.80 PSMD14 (0.66) PSMD14STAMBPCOPS5HPGDSPARP1
SCHEMBL19346770 0.80 PSMD14 (0.66) PSMD14STAMBPCOPS5HPGDSPARP1
SCHEMBL30547697 0.74 PSMD14 (0.54) PSMD14STAMBPCOPS5HPGDSPARP1
SCHEMBL7085565 0.74 PSMD14 (0.54) PSMD14STAMBPCOPS5HPGDSPARP1
SCHEMBL30290260 0.72 PSMD14 (0.53) PSMD14STAMBPCOPS5PARP1
SCHEMBL6986553 0.72 PSMD14 (0.68) PSMD14STAMBPCOPS5HPGDSPARP1
SCHEMBL2033745 0.72 PSMD14 (0.68) PSMD14STAMBPCOPS5PARP1

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-4399209-A1 NEW QUINOLINE DERIVATIVES Elanco Animal Health GmbH (DE) 2024-07-17 — — EP disclosed
EP-4255911-A1 BICYCLIC DERIVATIVES Elanco Tiergesundheit AG (CH) 2023-10-11 — — EP disclosed
WO-2023036821-A1 NEW QUINOLINE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2023-03-16 — — WO disclosed
WO-2022117783-A1 BICYCLIC DERIVATIVES ELANCO TIERGESUNDHEIT AG (CH) 2022-06-09 — — WO disclosed
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