SCHEMBL4640696

SCHEMBL4640696

COc1ccc(Nc2cnc3ccccc3n2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 5/20 0.72
PDGFRA P16234 5/20 0.72
RAB9A P51151 9/20 0.59
KMT2A Q03164 8/20 0.59
MEN1 O00255 7/20 0.59
MAPT P10636 4/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
LMNA P02545 2/20 0.59
KDM4E B2RXH2 1/20 0.59
NPC1 O15118 7/20 0.59
ALDH1A1 P00352 3/20 0.56
CASP3 P42574 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
HTT P42858 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
IGF1R P08069 1/20 0.56
POLB P06746 2/20 0.55
KDM1A O60341 1/20 0.55
RAD52 P43351 1/20 0.55

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
SCHEMBL15256286 0.86 PDGFRB (0.66) PDGFRBPDGFRARAB9AKMT2AMEN1
SCHEMBL1401415 0.84 PDGFRB (1.00) PDGFRBPDGFRARAB9AKMT2AMEN1
Hydrochloric Acid SCHEMBL3884102 0.82 PDGFRB (0.97) PDGFRBPDGFRARAB9AKMT2AMEN1
SCHEMBL8610333 0.81 PDGFRB (1.00) PDGFRBPDGFRARAB9AKMT2AMEN1
SCHEMBL1702887 0.81 PDGFRB (0.62) PDGFRBPDGFRARAB9AKMT2AMEN1
SCHEMBL31098987 0.79 RAB9A (0.61) PDGFRBPDGFRARAB9AKMT2AMEN1
SCHEMBL1702586 0.79 RAB9A (0.61) PDGFRBPDGFRARAB9AKMT2AMEN1
SCHEMBL27839336 0.79 PDGFRB (0.80) PDGFRBPDGFRARAB9AKMT2AMEN1
SCHEMBL6213413 0.79 PDGFRB (0.74) PDGFRBPDGFRARAB9AKMT2AMEN1
SCHEMBL16388913 0.79 PDGFRB (0.59) PDGFRBPDGFRARAB9AKMT2AMEN1

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-1267819-B1 Quinoxaline derivatives, compositions containing them und use as UV-filter MERCK PATENT GMBH (DE) 2008-08-06 EP claimed
US-20030207886-A1 Preparation containing quinoxaline derivatives MERCK PATENT GMBH (DE) 2003-11-06 US claimed
EP-1267819-A2 PREPARATION CONTAINING QUINOXALINE DERIVATIVES MERCK PATENT GmbH (DE) 2003-01-02 EP claimed
WO-2001068047-A2 PREPARATION CONTAINING QUINOXALINE DERIVATIVES MERCK PATENT GMBH (DE) 2001-09-20 WO claimed
EP-1267819-B1 Quinoxaline derivatives, compositions containing them und use as UV-filter MERCK PATENT GMBH (DE) 2008-08-06 EP disclosed
EP-1267819-B1 Quinoxaline derivatives, compositions containing them und use as UV-filter MERCK PATENT GMBH (DE) 2008-08-06 EP disclosed
US-20030207886-A1 Preparation containing quinoxaline derivatives MERCK PATENT GMBH (DE) 2003-11-06 US disclosed
EP-1267819-A2 PREPARATION CONTAINING QUINOXALINE DERIVATIVES MERCK PATENT GmbH (DE) 2003-01-02 EP disclosed
WO-2001068047-A2 PREPARATION CONTAINING QUINOXALINE DERIVATIVES MERCK PATENT GMBH (DE) 2001-09-20 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-20030207886-A1 Preparation containing quinoxaline derivatives CUTA, XPA, NQO2 PDGFRB 4344/4885PDGFRA 4218/4885RAB9A 989/4885

“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.