SCHEMBL3918795

SCHEMBL3918795

CCOc1cc2ncc(NCc3cccc(Br)c3)nc2cc1OCC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 4/20 0.59
PDGFRA P16234 4/20 0.59
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.44
EGFR P00533 6/20 0.43
ERBB2 P04626 4/20 0.43
FBP1 P09467 1/20 0.43
ERBB4 Q15303 1/20 0.42
APP P05067 2/20 0.41
GRM5 P41594 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
LMNA P02545 1/20 0.39
SLC26A6 Q9BXS9 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39

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
SCHEMBL3908347 0.89 PDGFRB (0.75) PDGFRBPDGFRAALOX15MAPK1EGFR
SCHEMBL3910327 0.86 PDGFRB (0.78) PDGFRBPDGFRAMAPK1EGFRERBB2
SCHEMBL6381492 0.75 EGFR (0.71) EGFRERBB2
SCHEMBL3908370 0.75 PDGFRB (1.00) PDGFRBPDGFRAALOX15MAPK1EGFR
SCHEMBL780389 0.73 MAP4K4 (0.50) PDGFRBPDGFRAMAPK1EGFRAPP
SCHEMBL18171881 0.73 PDGFRB (0.61) PDGFRBPDGFRAKDM4EALDH1A1HPGD
SCHEMBL3911842 0.70 PDGFRB (0.74) PDGFRBPDGFRAEGFRKDM4EALDH1A1
SCHEMBL22792292 0.70 ALOX15 (0.44) PDGFRBPDGFRAALOX15MAPK1APP
SCHEMBL782040 0.68 HRH4 (0.46) PDGFRBPDGFRA
SCHEMBL3917671 0.68 FBP1 (0.59) PDGFRBPDGFRAMAPK1EGFRERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7550597-B2 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases AVENTIS PHARMACEUTICALS, INC. (US) 2009-06-23 US disclosed
US-20050182054-A1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases AVENTIS PHARMACEUTICALS INC. (US) 2005-08-18 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-20050182054-A1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases LCK, LTK, ABL1 PDGFRB 39/4885PDGFRA 45/4885ALOX15 2404/4885

“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.