SCHEMBL28294451

SCHEMBL28294451

CC(C)(C)c1ccc(C(=O)NNc2c(Br)cccc2Br)cc1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
HDAC1 Q13547 2/20 0.54
POLB P06746 1/20 0.53
GAA P10253 4/20 0.52
MAPT P10636 1/20 0.50
RAB9A P51151 1/20 0.49
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.47
HDAC3 O15379 2/20 0.47
HDAC8 Q9BY41 2/20 0.47
HDAC6 Q9UBN7 2/20 0.47
HDAC2 Q92769 1/20 0.47
KCNK9 Q9NPC2 1/20 0.47
HDAC11 Q96DB2 1/20 0.46
ESRRG P62508 1/20 0.46
HPGD P15428 1/20 0.45
SRD5A2 P31213 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
SCHEMBL4463757 0.84 HDAC1 (0.58) MEN1KMT2ASMN1; SMN2HDAC1POLB
SCHEMBL28605755 0.83 POLB (0.54) MEN1KMT2ASMN1; SMN2HDAC1POLB
SCHEMBL28610788 0.80 GAA (0.56) SMN1; SMN2POLBGAAMAPTRAB9A
SCHEMBL28604661 0.80 ALDH1A1 (0.61) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL14438185 0.77 POLB (0.81) MEN1KMT2ASMN1; SMN2HDAC1POLB
SCHEMBL46184 0.76 MEN1 (0.71) MEN1KMT2ASMN1; SMN2HDAC1POLB
SCHEMBL4476444 0.74 RAB9A (0.60) MEN1KMT2ASMN1; SMN2HDAC1POLB
SCHEMBL3288511 0.73 RAB9A (0.68) MEN1KMT2ASMN1; SMN2HDAC1POLB
SCHEMBL4468028 0.73 SMN1; SMN2 (0.43) MEN1KMT2ASMN1; SMN2HDAC1MAPT
SCHEMBL1041220 0.73 RAB9A (0.64) MEN1KMT2ASMN1; SMN2HDAC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109758442-B Application of diaryl hydrazide compound in preparation of anti-influenza virus medicine 武汉大学 2021-08-17 CN claimed
CN-109758442-A Diaryl hydrazide kind compound is preparing the application in anti-influenza virus medicament 武汉大学 2019-05-17 CN claimed
CN-109758442-B Application of diaryl hydrazide compound in preparation of anti-influenza virus medicine 武汉大学 2021-08-17 CN disclosed
CN-109758442-A Diaryl hydrazide kind compound is preparing the application in anti-influenza virus medicament 武汉大学 2019-05-17 CN disclosed