SCHEMBL4814224

SCHEMBL4814224

FC(F)(F)c1cc(Cl)c(-c2c(Cl)nc3ncnn3c2N2CCSCC2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
TSHR P16473 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MAPT P10636 2/20 0.41
HTT P42858 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
MBOAT4 Q96T53 3/20 0.39
GAA P10253 3/20 0.36
KDM4E B2RXH2 5/20 0.35
ALDH1A1 P00352 5/20 0.35
HPGD P15428 3/20 0.35
USP2 O75604 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.34
APP P05067 2/20 0.33

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
SCHEMBL4813093 0.89 TSHR (0.42) POLBTSHRSMN1; SMN2MAPTHTT
SCHEMBL4813137 0.85 TSHR (0.41) TSHRSMN1; SMN2MAPTHTTNPSR1
SCHEMBL4817224 0.81 ALDH1A1 (0.34) POLBTSHRSMN1; SMN2MAPTHTT
SCHEMBL6806818 0.80 MBOAT4 (0.45) POLBTSHRSMN1; SMN2MAPTHTT
SCHEMBL4818887 0.78 TSHR (0.37) POLBTSHRSMN1; SMN2MAPTHTT
SCHEMBL4811365 0.77 ALDH1A1 (0.35) POLBTSHRSMN1; SMN2MAPTHTT
SCHEMBL4820533 0.76 SMN1; SMN2 (0.38) POLBTSHRSMN1; SMN2HTTKMT2A
SCHEMBL8486163 0.72 ALDH1A1 (0.43) TSHRMAPTHTTNPSR1KMT2A
SCHEMBL4820762 0.72 TSHR (0.39) POLBTSHRSMN1; SMN2MAPTHTT
SCHEMBL4818734 0.71 ALDH1A1 (0.48) TSHRSMN1; SMN2MAPTHTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020068744-A1 Substituted-triazolopyrimidines as anticancer agents AMERICAN HOME PRODUCTS CORPORATION 2002-06-06 US claimed
US-7329663-B2 Substituted-triazolopyrimidines as anticancer agents WYETH (US) 2008-02-12 US disclosed
US-20020068744-A1 Substituted-triazolopyrimidines as anticancer agents AMERICAN HOME PRODUCTS CORPORATION 2002-06-06 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-20020068744-A1 Substituted-triazolopyrimidines as anticancer agents TUBB3, TUBA1C, TUBB1 POLB 1224/4885TSHR 2567/4885SMN1; SMN2 655/4885

“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.