SCHEMBL7355299

SCHEMBL7355299

O=P(O)(O)c1cnc2ccccc2n1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
HSD17B10 Q99714 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.45
PDE10A Q9Y233 1/20 0.44
KDM4E B2RXH2 3/20 0.43
HSP90AA1 P07900 1/20 0.43
HSP90AB1 P08238 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
BCHE P06276 1/20 0.42
GAA P10253 1/20 0.41
GPR3 P46089 1/20 0.41
PTK2 Q05397 1/20 0.40

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
SCHEMBL29007666 0.93 ALDH1A1 (0.43) ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2
SCHEMBL30567363 0.80 ALDH1A1 (0.44) ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2
SCHEMBL11282833 0.77 ALDH1A1 (0.46) ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2
SCHEMBL28883523 0.74 ALDH1A1 (0.40) ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2
SCHEMBL31552901 0.73 HDAC8 (0.47) ALDH1A1SMN1; SMN2KDM4EGAA
SCHEMBL5484638 0.73 HDAC8 (0.47) ALDH1A1SMN1; SMN2KDM4EGAA
SCHEMBL10374296 0.72 PDE10A (0.58) ALDH1A1HPGDALOX15HSD17B10PDE10A
Nitrogen SCHEMBL27690667 0.71 HDAC8 (0.44) ALDH1A1SMN1; SMN2KDM4EGAA
SCHEMBL15911967 0.71 ALDH1A1 (0.43) ALDH1A1HPGDALOX15HSD17B10SMN1; SMN2
SCHEMBL20379780 0.70 CA2 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108586531-A A kind of 2- phosphonos quinoxaline compound and preparation method thereof 郑州大学 2018-09-28 CN claimed
WO-1999009845-A1 IMIDAZOQUINOXALINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-04 WO claimed
US-20230035913-A1 NITRAPYRIN COMPOSITIONS FOR ENHANCING NITROGEN NUTRIENT USE EFFICIENCY AND IMPROVING PLANT GROWTH VERDESIAN LIFE SCIENCES U.S., LLC 2023-02-02 US disclosed
CN-115334884-A Chlorodiidine compositions for increasing nitrogen nutrient use efficiency and improving plant growth 沃戴申生命科学美国有限责任公司 2022-11-11 CN disclosed
WO-2021141855-A1 NITRAPYRIN COMPOSITIONS FOR ENHANCING NITROGEN NUTRIENT USE EFFICIENCY AND IMPROVING PLANT GROWH VERDESIAN LIFE SCIENCES U.S., LLC (US) 2021-07-15 WO disclosed
CN-108586531-A A kind of 2- phosphonos quinoxaline compound and preparation method thereof 郑州大学 2018-09-28 CN disclosed
CN-108586531-A A kind of 2- phosphonos quinoxaline compound and preparation method thereof 郑州大学 2018-09-28 CN disclosed
CN-108586531-A A kind of 2- phosphonos quinoxaline compound and preparation method thereof 郑州大学 2018-09-28 CN disclosed
US-6057304-A Quinoxaline-phosphonic acid derivatives SCHERING AKTIENGESELLSCHAFT (DE) 2000-05-02 US 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-20230035913-A1 NITRAPYRIN COMPOSITIONS FOR ENHANCING NITROGEN NUTRIENT USE EFFICIENCY AND IMPROVING PLANT GROWTH NANS, PNPO, PNP ALDH1A1 3821/4885HPGD 522/4885ALOX15 3647/4885

“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.