SCHEMBL28928858

SCHEMBL28928858

COCOc1ccc(C(=O)CNC(=O)c2ccc[nH]2)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.44
▸ MAPT P10636 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ LMNA P02545 1/20 0.41
▸ GAA P10253 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ RAB9A P51151 2/20 0.37
▸ PARP14 Q460N5 1/20 0.36
▸ PARP10 Q53GL7 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAOB P27338 1/20 0.35

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
SCHEMBL28928825 0.83 DAO (0.42) PARP10MAOB
SCHEMBL28928832 0.82 NPC1 (0.45) NPC1MAPTHSD17B10LMNAGAA
SCHEMBL28928852 0.81 GAA (0.42) NPC1LMNAGAAKDM4ERAB9A
SCHEMBL28928845 0.79 NPC1 (0.40) NPC1MAPTMAPK1HSD17B10LMNA
SCHEMBL28928836 0.75 KDM4E (0.43) LMNAGAAKDM4EPOLB
SCHEMBL28928821 0.75 GAA (0.47) NPC1MAPTLMNAGAAKDM4E
SCHEMBL28929418 0.72 NPC1 (0.59) NPC1MAPK1GAAKDM4ERAB9A
SCHEMBL28928862 0.71 KDM4E (0.41) NPC1LMNAGAAKDM4ERAB9A
SCHEMBL28929181 0.71 AOC3 (0.43) NPC1GAAKDM4ERAB9A
SCHEMBL6769847 0.71 MAOB (0.51) PARP14PARP10MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115583942-A 2-substituted 5-phenyl-oxazole derivative, preparation method thereof and application thereof as MNK (MNK) inhibitor 中国海洋大学 2023-01-10 — — CN disclosed
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