SCHEMBL4935871

SCHEMBL4935871

COc1ccc(-c2ccc3ncnc(Nc4ccc(N5CCOCC5)cc4)c3c2)cc1O

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 16/20 0.64
BRAF P15056 16/20 0.64
MAPT P10636 1/20 0.62
MAPK1 P28482 1/20 0.62
AHR P35869 1/20 0.62
HTT P42858 1/20 0.62
PI4KB Q9UBF8 1/20 0.61
RET P07949 1/20 0.54
KIF5B P33176 1/20 0.54
KDR P35968 1/20 0.54
AURKA O14965 1/20 0.51
EGFR P00533 1/20 0.51
INSR P06213 1/20 0.51
IGF1R P08069 1/20 0.51
CDK4 P11802 1/20 0.51
AURKB Q96GD4 1/20 0.51

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
SCHEMBL4931410 0.91 MAPT (0.66) RAF1BRAFMAPTMAPK1AHR
SCHEMBL4938676 0.87 MAPT (0.60) RAF1BRAFMAPTMAPK1AHR
SCHEMBL4758836 0.87 MAPT (0.60) RAF1BRAFMAPTMAPK1AHR
SCHEMBL4008515 0.87 MAPT (0.80) RAF1BRAFMAPTMAPK1AHR
SCHEMBL4889795 0.85 MAPK1 (0.64) RAF1BRAFMAPTMAPK1AHR
SCHEMBL4940130 0.84 KDR (0.62) BRAFMAPTMAPK1AHRHTT
SCHEMBL4937051 0.84 KDR (0.62) BRAFMAPTMAPK1AHRHTT
SCHEMBL4789541 0.83 MAPT (0.66) RAF1BRAFMAPTMAPK1AHR
SCHEMBL4890620 0.83 EGFR (0.71) MAPTMAPK1AHRHTTRET
SCHEMBL4007152 0.82 MAPK1 (0.72) MAPTMAPK1AHRHTTPI4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080267914-A1 Chemical Compounds ASTRAZENECA AB (SE) 2008-10-30 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-20080267914-A1 Chemical Compounds RNASEL, ZC3HAV1L, RNASEH1 RAF1 744/4885BRAF 1306/4885MAPT 4645/4885

“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.