SCHEMBL3099241

SCHEMBL3099241

O=C(O)c1ccccc1ON=Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
KMT2A Q03164 6/20 0.46
MEN1 O00255 5/20 0.46
MAPT P10636 4/20 0.46
RAB9A P51151 3/20 0.46
MAPK1 P28482 3/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
NPC1 O15118 1/20 0.44
TNNI3 P19429 1/20 0.44
TNNT2 P45379 1/20 0.44
TNNC1 P63316 1/20 0.44
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42

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
SCHEMBL28308425 0.99 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2TDP1KMT2AMEN1
SCHEMBL27565532 0.88 CA1 (0.43) ALDH1A1SMN1; SMN2TDP1KMT2AMEN1
SCHEMBL3099247 0.87 KMT2A (0.47) ALDH1A1SMN1; SMN2TDP1KMT2AMEN1
SCHEMBL3099251 0.85 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2TDP1KMT2AMEN1
SCHEMBL6885835 0.84 KDM4E (0.50) ALDH1A1SMN1; SMN2TDP1KMT2AMEN1
SCHEMBL3632470 0.78 TSHR (0.46) ALDH1A1TDP1KMT2AMEN1MAPT
SCHEMBL38666081 0.77 IDE (0.65) ALDH1A1SMN1; SMN2TDP1KMT2AMEN1
SCHEMBL3626928 0.77 IDE (0.65) ALDH1A1SMN1; SMN2TDP1KMT2AMEN1
SCHEMBL9822636 0.77 KDM4E (0.42) ALDH1A1TDP1KMT2AMEN1MAPT
SCHEMBL4452102 0.76 KMT2A (0.55) ALDH1A1SMN1; SMN2TDP1KMT2AMEN1

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-102519959-B Highly sensitive pH test paper and preparation method thereof SHANGHAI XINSHENGSHI CHEMICAL SCIENCE CO LTD 2014-05-07 CN claimed
CN-102519959-B Highly sensitive pH test paper and preparation method thereof SHANGHAI XINSHENGSHI CHEMICAL SCIENCE CO LTD 2014-05-07 CN disclosed
US-8476390-B2 Light filters comprising P-nitrophenylazo salicylic acid derivatives thereof ARES CAPITAL CORPORATION, AS COLLATERAL AGENT 2013-07-02 US disclosed
US-8476390-B2 Light filters comprising P-nitrophenylazo salicylic acid derivatives thereof ARES CAPITAL CORPORATION, AS COLLATERAL AGENT 2013-07-02 US disclosed
US-20100256306-A1 LIGHT FILTERS COMPRISING P-NITROPHENYLAZO SALICYLIC ACID DERIVATIVES THEREOF ARES CAPITAL CORPORATION, AS COLLATERAL AGENT 2010-10-07 US disclosed
EP-2150588-A2 POLYMERIC DYES BASED ON POLYMERIZABLE VINYL-GROUP CONTAINIG P-NITROPHENYL-AZO SALICYLIC ACID DERIVATIVES Benz Research and Development Corporation (US) 2010-02-10 EP disclosed
WO-2008134555-A2 POLYMERIC DYES BASED ON POLYMERIZABLE VINYL-GROUP CONTAINING P-NITROPHENYL-AZO SALICYLIC ACID DERIVATIVES BENZ RESEARCH AND DEVELOPMENT CORPORATION (US) 2008-11-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100256306-A1 LIGHT FILTERS COMPRISING P-NITROPHENYLAZO SALICYLIC ACID DERIVATIVES THEREOF UACA, SUN2, VHL ALDH1A1 356/4885SMN1; SMN2 4031/4885TDP1 2883/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.