SCHEMBL29263262

SCHEMBL29263262

O=C(CCl)Nc1ccc([N+](=O)[O-])c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
LMNA P02545 5/20 0.51
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
RECQL P46063 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.48
MAPT P10636 4/20 0.48
HTT P42858 3/20 0.48
ATM Q13315 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 1/20 0.47
PRMT1 Q99873 1/20 0.46
POLB P06746 1/20 0.45

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
SCHEMBL6769086 0.88 LMNA (0.64) ALDH1A1LMNAMEN1KMT2ARECQL
SCHEMBL9666829 0.87 ALDH1A1 (0.52) ALDH1A1LMNAMEN1KMT2ARECQL
SCHEMBL4652739 0.85 LMNA (0.51) ALDH1A1LMNAMEN1KMT2ARECQL
SCHEMBL28355465 0.85 LMNA (0.51) ALDH1A1LMNAMEN1KMT2ARECQL
SCHEMBL11263484 0.84 MEN1 (0.52) ALDH1A1LMNAMEN1KMT2ARECQL
SCHEMBL20560675 0.83 ATM (0.51) ALDH1A1LMNAMEN1KMT2ARECQL
SCHEMBL85930 0.83 MAPT (0.49) ALDH1A1LMNAMEN1KMT2ARECQL
SCHEMBL11525238 0.82 ALDH1A1 (0.59) ALDH1A1LMNAMEN1KMT2ARECQL
SCHEMBL17653922 0.81 LMNA (0.56) ALDH1A1LMNAMEN1KMT2ARECQL
SCHEMBL17653920 0.81 LMNA (0.56) ALDH1A1LMNAMEN1KMT2ARECQL

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-118126030-A Preparation method of pyrazoline-1, 3, 4-oxadiazole thioacetamide derivative and application of pyrazoline-1, 3, 4-oxadiazole thioacetamide derivative as pesticide 贵州大学 2024-06-04 CN disclosed