SCHEMBL6314591

SCHEMBL6314591

O=C1N=NC(O)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
ALDH1A1 P00352 3/20 0.36
EDNRB P24530 1/20 0.35
EDNRA P25101 1/20 0.35
ALOX15 P16050 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP2D6 P10635 1/20 0.34
PKM P14618 2/20 0.33
RAB9A P51151 2/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
NCOR2 Q9Y618 1/20 0.33
MAOA P21397 1/20 0.33

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
SCHEMBL6080166 0.79 EDNRB (0.41) MEN1KMT2APOLBALDH1A1EDNRB
SCHEMBL1032657 0.76 KMT2A (0.40) MEN1KMT2APOLBALDH1A1ALOX15
SCHEMBL11052520 0.76 POLB (0.40) MEN1KMT2APOLBALDH1A1EDNRB
SCHEMBL4060635 0.76 MEN1 (0.40) MEN1KMT2APOLBALDH1A1EDNRB
SCHEMBL11411069 0.76 POLB (0.40) MEN1KMT2APOLBALDH1A1ALOX15
SCHEMBL9617399 0.76 MEN1 (0.40) MEN1KMT2APOLBALDH1A1EDNRB
SCHEMBL11416663 0.76 MEN1 (0.36) MEN1KMT2APOLBALDH1A1EDNRB
Sulfuric Acid SCHEMBL3440649 0.75 MEN1 (0.33) MEN1KMT2APOLBALDH1A1EDNRB
SCHEMBL8011185 0.73 ALDH1A1 (0.46) MEN1KMT2APOLBALDH1A1EDNRB
SCHEMBL10670754 0.73 MEN1 (0.38) MEN1KMT2APOLBALDH1A1EDNRB

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
US-20050033050-A1 Phthalazinones and the use thereof in order to combat undesirable microorganisms BAYER CROPSCIENCE AG (DE) 2005-02-10 US claimed
EP-1430035-A1 PHTHALAZINONES AND THE USE THEREOF IN ORDER TO COMBAT UNDESIRABLE MICROORGANISMS Bayer CropScience AG (DE) 2004-06-23 EP claimed
WO-2003024938-A1 PHTHALAZINONES AND THE USE THEREOF IN ORDER TO COMBAT UNDESIRABLE MICROORGANISMS BAYER CROPSCIENCE AG (DE) 2003-03-27 WO claimed
US-20050033050-A1 Phthalazinones and the use thereof in order to combat undesirable microorganisms BAYER CROPSCIENCE AG (DE) 2005-02-10 US disclosed
EP-1430035-A1 PHTHALAZINONES AND THE USE THEREOF IN ORDER TO COMBAT UNDESIRABLE MICROORGANISMS Bayer CropScience AG (DE) 2004-06-23 EP disclosed
WO-2003024938-A1 PHTHALAZINONES AND THE USE THEREOF IN ORDER TO COMBAT UNDESIRABLE MICROORGANISMS BAYER CROPSCIENCE AG (DE) 2003-03-27 WO disclosed
US-4112080-A INSECTICIDE, MITICIDE, NEMATOCIDE BAYER AKTIENGESELLSCHAFT (DE) 1978-09-05 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-20050033050-A1 Phthalazinones and the use thereof in order to combat undesirable microorganisms PGLS, DCXR, C5 MEN1 347/4885KMT2A 1531/4885POLB 1311/4885

“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.