SCHEMBL28670371

SCHEMBL28670371

O=C(ON=Cc1c(F)cccc1Cl)N1CCCc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
ATM Q13315 1/20 0.49
LMNA P02545 2/20 0.47
TSHR P16473 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
RAB9A P51151 1/20 0.45
PDE4B Q07343 3/20 0.44
PDE4D Q08499 1/20 0.44
NOTUM Q6P988 1/20 0.43
GAA P10253 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
SCHEMBL30592286 1.00 ALDH1A1 (0.52) ALDH1A1ATMLMNATSHRMEN1
SCHEMBL30592356 0.84 ALDH1A1 (0.71) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL28666388 0.84 ALDH1A1 (0.53) ALDH1A1ATMTSHRMEN1KMT2A
SCHEMBL30592376 0.84 ALDH1A1 (0.53) ALDH1A1ATMTSHRMEN1KMT2A
SCHEMBL28678763 0.84 ALDH1A1 (0.71) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL28660072 0.79 MEN1 (0.64) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL30592451 0.79 KMT2A (0.54) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL28665736 0.79 KMT2A (0.54) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL30592270 0.79 MEN1 (0.64) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL30592401 0.79 ALDH1A1 (0.48) ALDH1A1LMNATSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113816902-B Oxime ether (ester) compound, preparation method and application 西北农林科技大学 2023-09-01 CN disclosed
CN-113816902-A Oxime ether (ester) compound, preparation method and application 西北农林科技大学 2021-12-21 CN disclosed