SCHEMBL1457434

SCHEMBL1457434

O=CNc1cccc(C(=O)Nc2ccc(Oc3ncnc(Oc4ccccc4)c3F)cc2)c1O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
PNLIP P16233 1/20 0.46
KDR P35968 4/20 0.45
HPGD P15428 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HTT P42858 1/20 0.43
FLT1 P17948 1/20 0.43
CSF1R P07333 1/20 0.42
NPC1 O15118 1/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
STK39 Q9UEW8 1/20 0.41
MEN1 O00255 1/20 0.41
MAPK1 P28482 2/20 0.41
GFER P55789 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL7074399 0.86 PNLIP (0.61) KMT2APNLIPSTK39MEN1MAPK1
SCHEMBL1457413 0.80 KMT2A (0.52) KMT2APNLIPKDRHPGDKDM4E
SCHEMBL7556185 0.80 KMT2A (0.47) KMT2APNLIPKDRHPGDKDM4E
SCHEMBL1457071 0.78 RXFP1 (0.56) KMT2AHPGDKDM4EHTTMEN1
SCHEMBL7080494 0.78 PNLIP (0.62) KMT2APNLIPHPGDKDM4EHTT
SCHEMBL7077257 0.76 RXFP1 (0.60) KDRSTK39RXFP1
SCHEMBL7160758 0.76 SMO (0.52) KMT2AHPGDKDM4EHTTMEN1
SCHEMBL7073943 0.75 PKM (0.47) PNLIPMAPK1GFERRXFP1
SCHEMBL7074417 0.73 TLR8 (0.49) PNLIPSTK39MAPK1GFERRXFP1
SCHEMBL2238659 0.73 PGR (0.49) KMT2APNLIPKDRHPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1533303-B1 Substituted Aminosalicylacid Amides ( intermediates ) BAYER CROPSCIENCE AG (DE) 2013-04-24 EP disclosed
EP-1533303-B1 Substituted Aminosalicylacid Amides ( intermediates ) BAYER CROPSCIENCE AG (DE) 2013-04-24 EP disclosed
EP-2292608-A1 Intermediates for the preparation of substituted Aminosalicylic acid amides with fungicidal activity Bayer CropScience AG (DE) 2011-03-09 EP disclosed
EP-2292608-A1 Intermediates for the preparation of substituted Aminosalicylic acid amides with fungicidal activity Bayer CropScience AG (DE) 2011-03-09 EP disclosed
EP-0970057-B1 SUBSTITUTED AMINOSALICYCLIC ACID AMIDES WITH FUNGICIDAL EFFECT AND INTERMEDIATE PRODUCTS FOR PRODUCTION THEREOF BAYER CROPSCIENCE AG (DE) 2006-02-01 EP disclosed
EP-1533303-A1 Substituted Aminosalicylacid Amides ( intermediates ) Bayer CropScience AG (DE) 2005-05-25 EP disclosed
US-6380386-B2 INSECTICIDES, BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 2002-04-30 US disclosed
US-20020006958-A1 Substituted aminosalicylic acid amides with fungicidal effect and intermediate products for production thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2002-01-17 US disclosed
US-6194418-B1 Substituted aminosalicyclic acid amides with fungicidal effect and intermediate products for production thereof BAYER AKTIENGESELLSCHAFT (DE) 2001-02-27 US disclosed
EP-0970057-A2 SUBSTITUTED AMINOSALICYCLIC ACID AMIDES WITH FUNGICIDAL EFFECT AND INTERMEDIATE PRODUCTS FOR PRODUCTION THEREOF BAYER AG (DE) 2000-01-12 EP disclosed
WO-1998041513-A2 SUBSTITUTED AMINOSALICYCLIC ACID AMIDES WITH FUNGICIDAL EFFECT AND INTERMEDIATE PRODUCTS FOR PRODUCTION THEREOF BAYER AKTIENGESELLSCHAFT (DE) 1998-09-24 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-20020006958-A1 Substituted aminosalicylic acid amides with fungicidal effect and intermediate products for production thereof AADAC, DDC, DAO KMT2A 1930/4885PNLIP 4717/4885KDR 3411/4885

“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.