SCHEMBL6846664

SCHEMBL6846664

O=C(O)NC1CCN(c2ncnc3oc(-c4ccc(Br)cc4)c(-c4ccc(F)cc4)c23)CC1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AURKA O14965 4/20 0.55
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48
PAK1 Q13153 3/20 0.41
MERTK Q12866 1/20 0.40
KDR P35968 1/20 0.40
TEK Q02763 1/20 0.40
MAPT P10636 1/20 0.39
CHEK1 O14757 1/20 0.38
KIT P10721 1/20 0.38
RPS6KB1 P23443 1/20 0.38
TNK2 Q07912 1/20 0.37
TRPV1 Q8NER1 1/20 0.37

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
SCHEMBL6198397 0.87 AURKA (0.50) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6200961 0.86 AURKA (0.71) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6203305 0.86 AURKA (0.49) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6201890 0.82 AURKA (0.51) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6202459 0.80 ALDH1A1 (0.53) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6202985 0.79 AURKA (0.87) AURKAALDH1A1HPGDTSHRHSD17B10
Hydrochloric Acid SCHEMBL6204384 0.76 AURKA (0.44) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6848492 0.76 AURKA (0.44) AURKAALDH1A1HPGDTSHRHSD17B10
Hydrochloric Acid SCHEMBL6202056 0.75 AURKA (0.51) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6203462 0.74 AURKA (0.42) AURKAALDH1A1HPGDTSHRHSD17B10

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-20040259888-A1 Novel 4-aminofuropyrimidines and the use thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2004-12-23 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-20040259888-A1 Novel 4-aminofuropyrimidines and the use thereof DPYD, TPMT, TYMP AURKA 795/4885ALDH1A1 176/4885HPGD 389/4885

“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.