SCHEMBL28355465

SCHEMBL28355465

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

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.51
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
ALDH1A1 P00352 5/20 0.51
RECQL P46063 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.48
MAPT P10636 3/20 0.48
HTT P42858 2/20 0.48
TDP1 Q9NUW8 2/20 0.47
ATM Q13315 1/20 0.47
AR P10275 2/20 0.46
KDM4E B2RXH2 1/20 0.45
PKM P14618 1/20 0.44
MAPK1 P28482 1/20 0.44
HPGD P15428 1/20 0.43

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
SCHEMBL4652739 0.88 LMNA (0.51) LMNAMEN1KMT2AALDH1A1RECQL
SCHEMBL9666829 0.87 ALDH1A1 (0.52) LMNAMEN1KMT2AALDH1A1RECQL
SCHEMBL29263262 0.85 ALDH1A1 (0.51) LMNAMEN1KMT2AALDH1A1RECQL
SCHEMBL5069543 0.84 CYP19A1 (0.50) LMNAMEN1KMT2AALDH1A1RECQL
SCHEMBL11638101 0.82 ALDH1A1 (0.59) LMNAMEN1KMT2AALDH1A1RECQL
SCHEMBL17653922 0.81 LMNA (0.56) LMNAMEN1KMT2AALDH1A1RECQL
SCHEMBL17653920 0.81 LMNA (0.56) LMNAMEN1KMT2AALDH1A1RECQL
SCHEMBL20560675 0.80 ATM (0.51) LMNAMEN1KMT2AALDH1A1RECQL
SCHEMBL2333062 0.80 HTT (0.61) LMNAMEN1KMT2AALDH1A1RECQL
SCHEMBL8481692 0.79 TSHR (0.59) LMNAMEN1KMT2AALDH1A1RECQL

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-110627655-B Synthetic method of 2-bromo-5-fluoro-4-nitroaniline and intermediate thereof 苏州旺山旺水生物医药有限公司 2022-09-20 CN disclosed
CN-110627655-A Synthetic method and intermediate of 2-bromo-5-fluoro-4-nitroaniline 苏州旺山旺水生物医药有限公司 2019-12-31 CN disclosed