SCHEMBL6202574

SCHEMBL6202574

Clc1ccc(-c2oc3ncnc(Cl)c3c2-c2ccccc2)cn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 1/20 0.53
ALDH1A1 P00352 3/20 0.47
HPGD P15428 3/20 0.47
KDM4E B2RXH2 2/20 0.47
UBE2N P61088 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TSHR P16473 2/20 0.46
HSD17B10 Q99714 2/20 0.46
AURKA O14965 8/20 0.45
CHEK1 O14757 3/20 0.45
MAP2K1 Q02750 1/20 0.45
EGFR P00533 2/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
KDR P35968 1/20 0.42
GSK3B P49841 1/20 0.42
MAPK1 P28482 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL6200319 0.88 ALDH1A1 (0.41) TNK2ALDH1A1HPGDKDM4EUBE2N
SCHEMBL735560 0.87 TNK2 (0.68) TNK2ALDH1A1HPGDKDM4EUBE2N
SCHEMBL1787179 0.83 TNK2 (0.58) TNK2ALDH1A1HPGDKDM4EUBE2N
SCHEMBL2977130 0.83 TNK2 (0.58) TNK2ALDH1A1HPGDKDM4EUBE2N
SCHEMBL6848486 0.83 TNK2 (0.58) TNK2ALDH1A1HPGDKDM4EUBE2N
SCHEMBL1785983 0.80 TNK2 (0.54) TNK2ALDH1A1HPGDKDM4EUBE2N
SCHEMBL2975999 0.80 KDM4E (0.74) TNK2ALDH1A1HPGDKDM4EUBE2N
SCHEMBL1785974 0.80 KDM4E (0.74) TNK2ALDH1A1HPGDKDM4EUBE2N
SCHEMBL6199702 0.78 AURKA (0.78) TNK2ALDH1A1HPGDKDM4EUBE2N
SCHEMBL6202380 0.78 NPC1 (0.43) TNK2ALDH1A1HPGDKDM4EUBE2N

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 TNK2 2813/4885ALDH1A1 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.