SCHEMBL29244181

SCHEMBL29244181

[N-]=[N+]=NOP(=O)(O)Oc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.52
ALDH1A1 P00352 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
POLB P06746 1/20 0.41
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ANPEP P15144 2/20 0.38
LAP3 P28838 2/20 0.38
KLK8 O60259 2/20 0.38
PLAU P00749 2/20 0.38
KLK2 P20151 2/20 0.38
KLK4 Q9Y5K2 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
GPR84 Q9NQS5 1/20 0.36

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
SCHEMBL98878 0.84 SRC (0.48) SRCALDH1A1L3MBTL1TDP1CYP2C9
SCHEMBL25426237 0.84 SRC (0.48) SRCALDH1A1L3MBTL1TDP1CYP2C9
SCHEMBL734215 0.83 SRC (0.61) SRCALDH1A1L3MBTL1TDP1POLB
Ammonia Solution, Strong SCHEMBL28118260 0.81 SRC (0.59) SRCALDH1A1L3MBTL1TDP1POLB
SCHEMBL6861177 0.79 SRC (0.57) SRCALDH1A1L3MBTL1TDP1POLB
SCHEMBL59584 0.79 SRC (0.57) SRCALDH1A1L3MBTL1TDP1POLB
SCHEMBL28622073 0.79 TDP1 (0.61) SRCL3MBTL1TDP1KDM4E
SCHEMBL27676341 0.78 SRC (0.73) SRCALDH1A1L3MBTL1TDP1POLB
SCHEMBL37038 0.78 SRC (0.73) SRCALDH1A1L3MBTL1TDP1POLB
Benzene SCHEMBL11142811 0.78 SRC (0.73) SRCALDH1A1L3MBTL1TDP1POLB

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-118291133-A Preparation method of pure red light perovskite quantum dot with excellent heat conduction performance 浙江大学 2024-07-05 CN claimed