SCHEMBL28928827

SCHEMBL28928827

CN(C)c1ccc(C(O)CNC(=O)c2ccc[nH]2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ POLB P06746 1/20 0.41
▸ TAAR1 Q96RJ0 1/20 0.41
▸ TP53 P04637 1/20 0.41

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
SCHEMBL28929404 0.84 NPC1 (0.62) KDM4EL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL28928843 0.83 POLB (0.50) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL28929179 0.83 NPC1 (0.47) CYP1A2CYP2D6KDM4ENPC1RAB9A
SCHEMBL28928872 0.83 LMNA (0.62) KDM4ENPC1RAB9ASMN1; SMN2LMNA
SCHEMBL28928818 0.82 NPC1 (0.51) CYP1A2CYP2D6KDM4EALDH1A1MAPT
SCHEMBL28929186 0.79 PKM (0.47) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL28928862 0.78 KDM4E (0.41) KDM4ENPC1RAB9ASMN1; SMN2LMNA
SCHEMBL28928841 0.76 CYP1A2 (0.48) CYP1A2CYP2D6KDM4EMEN1KMT2A
SCHEMBL13840109 0.74 KDM4E (0.56) KDM4EKMT2ALMNAPOLB
SCHEMBL28929413 0.73 GAA (0.45) KDM4EALDH1A1LMNA

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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