SCHEMBL30975201

SCHEMBL30975201

CN1CCN(Cc2cccnc2OC(N)=O)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.48
HTT P42858 2/20 0.48
LMNA P02545 1/20 0.48
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MAPT P10636 3/20 0.46
GAA P10253 1/20 0.46
METAP2 P50579 1/20 0.46
HTR6 P50406 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
KMT2A Q03164 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
NFKB1 P19838 1/20 0.42
RAB9A P51151 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42

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
SCHEMBL31007080 0.85 HTT (0.47) KDM4EHTTLMNAALDH1A1SMN1; SMN2
SCHEMBL7679923 0.81 MAPT (0.51) KDM4EALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL16737211 0.77 SLC13A5 (0.41) KDM4ELMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL30975206 0.75 METAP2 (0.50) KDM4ELMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL30975198 0.75 METAP2 (0.50) KDM4ELMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL30975199 0.74 MEN1 (0.50) KDM4EHTTLMNAALDH1A1SMN1; SMN2
SCHEMBL18753897 0.73 HTR6 (0.53) KDM4EALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL5779372 0.72 NPC1 (0.51) KDM4EHTTALDH1A1MAPTL3MBTL1
SCHEMBL5254250 0.72 METAP2 (0.50) KDM4EALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL19561794 0.72 METAP2 (0.56) KDM4EHTTLMNAALDH1A1SMN1; SMN2

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
WO-2024134514-A1 NOVEL COMPOUND AS RON INHIBITOR 주식회사 엘지화학 2024-06-27 WO disclosed