SCHEMBL6203300

SCHEMBL6203300

OC1CCN(c2ncnc3oc(-c4ccc(Nc5cccc(Cl)c5)cc4)c(-c4ccccc4)c23)CC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 7/20 0.71
ALDH1A1 P00352 1/20 0.52
HPGD P15428 1/20 0.52
TSHR P16473 1/20 0.52
HSD17B10 Q99714 1/20 0.52
STK3 Q13188 4/20 0.52
LRRK2 Q5S007 4/20 0.52
STK4 Q13043 3/20 0.52
EGFR P00533 6/20 0.45
AURKB Q96GD4 3/20 0.45
KDR P35968 2/20 0.45
CDC7 O00311 1/20 0.45
PLK4 O00444 1/20 0.45
CHEK1 O14757 1/20 0.45
PDPK1 O15530 1/20 0.45
JAK2 O60674 1/20 0.45
ROCK2 O75116 1/20 0.45
PAK4 O96013 1/20 0.45
CHEK2 O96017 1/20 0.45
NTRK1 P04629 1/20 0.45

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
SCHEMBL6202985 0.80 AURKA (0.87) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6199702 0.80 AURKA (0.78) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6202155 0.74 AURKA (0.73) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6204036 0.73 AURKA (0.69) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6200494 0.73 AURKA (0.71) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6200961 0.72 AURKA (0.71) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6200264 0.72 AURKA (0.64) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL12789817 0.69 ALDH1A1 (0.75) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL6201006 0.69 AURKA (0.66) AURKAALDH1A1HPGDTSHRHSD17B10
SCHEMBL31301556 0.69 LRRK2 (1.00) AURKASTK3LRRK2STK4EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1425283-B1 NOVEL 4-AMINOFUROPYRIMIDINES AND THE USE THEREOF BAYER HEALTHCARE AG (DE) 2005-03-16 EP disclosed
US-20040259888-A1 Novel 4-aminofuropyrimidines and the use thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2004-12-23 US disclosed
EP-1425283-A1 NOVEL 4-AMINOFUROPYRIMIDINES AND THE USE THEREOF Bayer HealthCare AG (DE) 2004-06-09 EP disclosed
WO-2003018589-A1 NOVEL 4-AMINOFUROPYRIMIDINES AND THE USE THEREOF BAYER HEALTHCARE AG (DE) 2003-03-06 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 (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.