SCHEMBL6835447

SCHEMBL6835447

C[Sn](C)(C)c1cncc(OCc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.46
PDGFRA P16234 1/20 0.46
MAOB P27338 5/20 0.45
ALOX5 P09917 1/20 0.44
CHRNB2 P17787 2/20 0.42
CHRNB4 P30926 2/20 0.42
CHRNA3 P32297 2/20 0.42
CHRNA7 P36544 2/20 0.42
CHRNA4 P43681 2/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42
CYP2C19 P33261 1/20 0.42
PTGS2 P35354 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HIF1A Q16665 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
GAA P10253 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
SCHEMBL8512404 0.83 MAOB (0.56) PDGFRBPDGFRAMAOBALOX5LMNA
SCHEMBL20314429 0.81 MAPK1 (0.49) PDGFRBPDGFRAMAOBALOX5CHRNB2
SCHEMBL29498709 0.80 PDGFRB (0.40) PDGFRBPDGFRAMAOBALOX5CHRNB2
SCHEMBL15049880 0.79 ALOX5 (0.47) PDGFRBPDGFRAMAOBALOX5CHRNB2
SCHEMBL13535019 0.79 AOC3 (0.54) PDGFRBPDGFRAMAOBALOX5CHRNB2
SCHEMBL13535014 0.79 PDGFRB (0.49) PDGFRBPDGFRAMAOBALOX5CHRNB2
SCHEMBL4538153 0.79 MAOB (0.67) PDGFRBPDGFRAMAOBALOX5MAPT
SCHEMBL6582384 0.77 CYP1A2 (0.56) PDGFRBPDGFRAMAOBALOX5LMNA
SCHEMBL18479100 0.76 ALOX5 (0.47) PDGFRBPDGFRAMAOBALOX5CHRNB2
SCHEMBL20832869 0.76 APP (0.53) PDGFRBPDGFRAMAOBALOX5CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6831175-B2 Such as N,N-dimethyl-N-(2-((5-((E)-2-pyridin-4-ylvinyl) pyridin-3-yl)oxy)ethyl)amine ABBOTT LABORATORIES 2004-12-14 US disclosed
EP-1463505-A2 3-(PHENYL-ALKOXY)-5-(PHENYL)-PYRIDINE DERIVATIVES AND RELATED COMPOUNDS AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER Abbott Laboratories (US) 2004-10-06 EP disclosed
US-20030199511-A1 Kinase inhibitors ABBVIE INC. 2003-10-23 US disclosed
US-20030187026-A1 Kinase inhibitors ABBOTT LABORATORIES 2003-10-02 US disclosed
WO-2003051366-A2 3-(PHENYL-ALKOXY)-5-(PHENYL)-PYRIDINE DERIVATIVES AND RELATED COMPOUNDS AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER ABBOTT LABORATORIES (US) 2003-06-26 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 (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-20030187026-A1 Kinase inhibitors MAP3K20, MAP3K19, MAP3K1 PDGFRB 1016/4885PDGFRA 1109/4885MAOB 2855/4885
US-20030199511-A1 Kinase inhibitors MAP3K20, MAP3K19, MAP3K1 PDGFRB 1016/4885PDGFRA 1109/4885MAOB 2855/4885

“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.