SCHEMBL5453371

SCHEMBL5453371

Fc1ccc(-c2nn3c(NC4CCCC4)cccc3c2Br)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
MAPK14 Q16539 3/20 0.42
FYN P06241 1/20 0.40
MAPT P10636 4/20 0.40
TP53 P04637 3/20 0.40
RXFP1 Q9HBX9 1/20 0.40
PIM1 P11309 2/20 0.36
TRPV1 Q8NER1 1/20 0.36
RAB9A P51151 1/20 0.35
ADORA3 P0DMS8 3/20 0.35
ADORA1 P30542 3/20 0.35
ADORA2A P29274 2/20 0.35
CSNK1E P49674 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL5457248 0.82 MAPK14 (0.64) ALOX5MAPK14ADORA3ADORA1ADORA2A
SCHEMBL5459554 0.81 ALOX5 (0.42) ALOX5MAPK14FYNMAPTTP53
SCHEMBL5453385 0.79 MAPK14 (0.51) ALOX5MAPK14FYNMAPTTP53
SCHEMBL5457302 0.79 MAPK14 (0.50) MAPK14
SCHEMBL5462426 0.78 MAPK14 (0.43) ALOX5MAPK14FYNADORA3ADORA1
SCHEMBL5209423 0.78 ADORA3 (0.43) MAPTADORA3ADORA1ADORA2AKDM4E
SCHEMBL5456838 0.77 CSNK1D (0.51) MAPK14
SCHEMBL5454714 0.76 MAPK14 (0.47) MAPK14PIM1CSNK1E
SCHEMBL5457242 0.76 PTGS2 (0.45) ALOX5MAPK14RAB9AKDM4EALDH1A1
SCHEMBL5462491 0.76 CSNK1D (0.51) MAPK14

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-20070287721-A1 Pyrazolopyridinyl pyridine BOYD F LESLIE 2007-12-13 US disclosed
EP-1377573-B1 PYRAZOLOPYRIDINE DERIVATIVES GLAXO GROUP LTD (GB) 2005-07-27 EP 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-20070287721-A1 Pyrazolopyridinyl pyridine CYP3A5, CYP2C19, CYP3A4 ALOX5 2299/4885MAPK14 2533/4885FYN 929/4885

“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.