SCHEMBL11534873

SCHEMBL11534873

O=C(O)c1cccc([N+](=O)[O-])c1.[KH]

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.96
CES2 O00748 1/20 0.72
CES1 P23141 1/20 0.72
TSHR P16473 3/20 0.68
ALDH1A1 P00352 3/20 0.68
PTPN1 P18031 1/20 0.61
PTPN12 Q05209 1/20 0.61
PTPN22 Q9Y2R2 1/20 0.61
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
KDM4E B2RXH2 1/20 0.59
LMNA P02545 1/20 0.59
PRSS1 P07477 1/20 0.59
PRSS2 P07478 1/20 0.59
PRSS3 P35030 1/20 0.59
MAPT P10636 2/20 0.58
MITF O75030 1/20 0.58
HSP90AA1 P07900 1/20 0.58
HTT P42858 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58

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
SCHEMBL132618 0.98 TP53 (1.00) TP53CES2CES1TSHRALDH1A1
SCHEMBL27709081 0.98 TP53 (1.00) TP53CES2CES1TSHRALDH1A1
SCHEMBL29490968 0.98 TP53 (1.00) TP53CES2CES1TSHRALDH1A1
Fluoride SCHEMBL28228052 0.96 TP53 (0.96) TP53CES2CES1TSHRALDH1A1
SCHEMBL11320128 0.96 TP53 (0.96) TP53CES2CES1TSHRALDH1A1
Ammonia Solution, Strong SCHEMBL1734091 0.96 TP53 (0.96) TP53CES2CES1TSHRALDH1A1
Water SCHEMBL28303785 0.96 TP53 (0.96) TP53CES2CES1TSHRALDH1A1
SCHEMBL8816405 0.96 TP53 (0.96) TP53CES2CES1TSHRALDH1A1
SCHEMBL10415666 0.96 TP53 (0.96) TP53CES2CES1TSHRALDH1A1
Hydrochloric Acid SCHEMBL3199181 0.96 TP53 (0.96) TP53CES2CES1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109881223-A Cyanogen-less gold liquid and its preparation method and application 深圳市联合蓝海科技开发有限公司 2019-06-14 CN claimed
CN-106148963-A A kind of environmental-protecting chemical stripping nickel agent and strip method thereof 惠州市博美环保新材料有限公司 2016-11-23 CN claimed
CN-114959709-B Environment-friendly nickel removing agent 湖南丽臣奥威实业有限公司 2025-02-11 CN disclosed
CN-114959709-A Environment-friendly nickel removing agent 湖南丽臣奥威实业有限公司 2022-08-30 CN disclosed
CN-109881223-A Cyanogen-less gold liquid and its preparation method and application 深圳市联合蓝海科技开发有限公司 2019-06-14 CN disclosed
CN-106148963-A A kind of environmental-protecting chemical stripping nickel agent and strip method thereof 惠州市博美环保新材料有限公司 2016-11-23 CN disclosed
US-4132550-A Photoresists with particles less than one micron MOTOROLA, INC. (US) 1979-01-02 US disclosed