SCHEMBL4034237

SCHEMBL4034237

O=C1Cc2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2N1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.58
KMT2A Q03164 4/20 0.54
MEN1 O00255 3/20 0.54
RAB9A P51151 3/20 0.54
HTT P42858 2/20 0.54
ALDH1A1 P00352 3/20 0.53
MAPT P10636 2/20 0.53
THRB P10828 1/20 0.52
GAA P10253 1/20 0.51
NCOA1 Q15788 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NCOA3 Q9Y6Q9 1/20 0.51
NPC1 O15118 1/20 0.50
P2RX1 P51575 1/20 0.50
ABCG2 Q9UNQ0 1/20 0.47

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
SCHEMBL4034977 0.91 CASP3 (0.58) CASP3KMT2AMEN1RAB9AHTT
SCHEMBL6543874 0.81 FADS1 (0.50) KMT2AP2RX1
SCHEMBL395950 0.78 TRPV1 (0.59) CASP3RAB9AHTTGAASMN1; SMN2
SCHEMBL5627831 0.78 MEN1 (0.55) CASP3KMT2AMEN1RAB9AHTT
SCHEMBL397661 0.76 MEN1 (0.63) CASP3KMT2AMEN1RAB9AHTT
SCHEMBL11735609 0.75 RAB9A (0.58) CASP3KMT2AMEN1RAB9AHTT
SCHEMBL12857582 0.74 CASP3 (0.91) CASP3KMT2AMEN1RAB9AHTT
SCHEMBL13442870 0.74 CASP3 (1.00) CASP3KMT2AMEN1RAB9AHTT
SCHEMBL12553629 0.73 MEN1 (0.74) CASP3KMT2AMEN1RAB9AHTT
SCHEMBL995085 0.73 GAA (0.77) KMT2AMEN1RAB9AHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1392680-B1 SELECTIVE ANTHRANILAMIDE PYRIDINE AMIDES AS INHIBITORS OF VEGFR-2 AND VEGFR-3 BAYER SCHERING PHARMA AG (DE) 2009-07-22 EP disclosed
US-20040254185-A1 Selective anthranilamide pyridine amides as inhibitors of vegfr-2 and vegfr-3 BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2004-12-16 US disclosed
CN-1518546-A Selective anthranilamide picolinamides as VEGRF-2 and VEGFR-3 inhibitors ���ֹɷݹ�˾ 2004-08-04 CN disclosed
US-20040039019-A1 Selected anthranilaminde pyridinamides and their use as pharmaceutical agents SCHERING AG (DE) 2004-02-26 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 (2 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-20040039019-A1 Selected anthranilaminde pyridinamides and their use as pharmaceutical agents KDR, FLT1, FLT4 CASP3 896/4885KMT2A 3109/4885MEN1 2641/4885
US-20040254185-A1 Selective anthranilamide pyridine amides as inhibitors of vegfr-2 and vegfr-3 FLT4, KDR, FLT1 CASP3 542/4885KMT2A 1262/4885MEN1 3913/4885

“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.