SCHEMBL30605656

SCHEMBL30605656

NC(=O)OCc1ccccc1[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.54
ALDH1A1 P00352 6/20 0.51
TSHR P16473 1/20 0.51
HTT P42858 1/20 0.51
HPGD P15428 1/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MAPT P10636 1/20 0.47
CTSD P07339 1/20 0.46
LMNA P02545 2/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
CCR5 P51681 1/20 0.44

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
SCHEMBL37410 1.00 MAOB (0.54) MAOBALDH1A1TSHRHTTHPGD
Tromethamine SCHEMBL15321748 0.90 MAOB (0.49) MAOBALDH1A1TSHRHTTHPGD
Phenylacetic Acid SCHEMBL11795869 0.89 MAOB (0.45) MAOBALDH1A1TSHRHTTMEN1
SCHEMBL31375129 0.88 KMT2A (0.51) MAOBALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL4444551 0.88 MAOB (0.49) MAOBALDH1A1TSHRHTTHPGD
SCHEMBL286962 0.86 MAOB (0.56) MAOBALDH1A1TSHRHTTHPGD
SCHEMBL5490051 0.86 GPR35 (0.47) MAOBALDH1A1TSHRHTTMEN1
SCHEMBL888155 0.85 ALDH1A1 (0.50) MAOBALDH1A1TSHRHTTHPGD
SCHEMBL602067 0.85 MAOB (0.55) MAOBALDH1A1TSHRHTTHPGD
SCHEMBL5932809 0.85 MAOB (0.55) MAOBALDH1A1TSHRHTTHPGD

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-116744943-A Antibody-oligonucleotide complexes and uses thereof 达因疗法公司 2023-09-12 CN disclosed