SCHEMBL23359134

SCHEMBL23359134

O=C(O)c1ccc(NC(c2ccccc2)c2ccc3cccnc3c2O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RCE1 Q9Y256 10/20 1.00
P4HB P07237 4/20 1.00
TP53 P04637 4/20 1.00
CYP2C9 P11712 4/20 1.00
CYP2C19 P33261 4/20 1.00
HIF1A Q16665 4/20 1.00
ALDH1A1 P00352 3/20 1.00
HSD17B10 Q99714 3/20 1.00
CYP3A4 P08684 2/20 1.00
CYP1A2 P05177 2/20 1.00
HPGD P15428 2/20 1.00
ALOX15 P16050 1/20 0.76
HSP90AA1 P07900 2/20 0.72
SLC2A1 P11166 1/20 0.67
JMJD7 P0C870 1/20 0.66
CYP2D6 P10635 1/20 0.66

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
SCHEMBL29962903 1.00 RCE1 (1.00) RCE1P4HBTP53CYP2C9CYP2C19
SCHEMBL31741895 1.00 RCE1 (1.00) RCE1P4HBTP53CYP2C9CYP2C19
SCHEMBL31741894 1.00 RCE1 (1.00) RCE1P4HBTP53CYP2C9CYP2C19
SCHEMBL11955293 0.89 P4HB (1.00) RCE1P4HBTP53CYP2C9CYP2C19
SCHEMBL14955656 0.88 RCE1 (0.83) RCE1P4HBTP53CYP2C9CYP2C19
SCHEMBL14955655 0.88 RCE1 (0.83) RCE1P4HBTP53CYP2C9CYP2C19
SCHEMBL23875092 0.87 TP53 (0.81) RCE1P4HBTP53CYP2C9CYP2C19
SCHEMBL11955279 0.86 RCE1 (1.00) RCE1P4HBTP53CYP2C9CYP2C19
SCHEMBL16501076 0.86 RCE1 (0.84) RCE1P4HBTP53CYP2C9CYP2C19
SCHEMBL1700877 0.86 RCE1 (0.74) RCE1P4HBTP53CYP2C9CYP2C19

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
EP-4057813-A1 COMPOSITIONS AND METHODS FOR TREATING HUANGLONGBING DISEASE IN CITRUS New Life Crop Sciences LLC (US) 2022-09-21 EP claimed
CN-114980736-A Compositions and methods for treating citrus greening disease 新生命作物科学有限责任公司 2022-08-30 CN claimed
US-20210144998-A1 COMPOSITIONS AND METHODS FOR TREATING HUANGLONGBING DISEASE IN CITRUS NEW LIFE CROP SCIENCES LLC 2021-05-20 US claimed
WO-2021097410-A1 COMPOSITIONS AND METHODS FOR TREATING HUANGLONGBING DISEASE IN CITRUS NEW LIFE CROP SCIENCES LLC (US) 2021-05-20 WO claimed
EP-4057813-A1 COMPOSITIONS AND METHODS FOR TREATING HUANGLONGBING DISEASE IN CITRUS New Life Crop Sciences LLC (US) 2022-09-21 EP disclosed
CN-114980736-A Compositions and methods for treating citrus greening disease 新生命作物科学有限责任公司 2022-08-30 CN disclosed
US-20210144998-A1 COMPOSITIONS AND METHODS FOR TREATING HUANGLONGBING DISEASE IN CITRUS NEW LIFE CROP SCIENCES LLC 2021-05-20 US disclosed
US-20210144998-A1 COMPOSITIONS AND METHODS FOR TREATING HUANGLONGBING DISEASE IN CITRUS NEW LIFE CROP SCIENCES LLC 2021-05-20 US disclosed
WO-2021097410-A1 COMPOSITIONS AND METHODS FOR TREATING HUANGLONGBING DISEASE IN CITRUS NEW LIFE CROP SCIENCES LLC (US) 2021-05-20 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-20210144998-A1 COMPOSITIONS AND METHODS FOR TREATING HUANGLONGBING DISEASE IN CITRUS PNPO, G6PD, AGXT RCE1 3803/4885P4HB 2212/4885TP53 1665/4885

“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.