SCHEMBL4875217

SCHEMBL4875217

O=C(O)c1cc2c(s1)c(-c1ccccc1)c(-c1ccc3nc(-c4ccccc4C(F)(F)F)ccc3c1)n2CC(=O)N1CCC(N2CCCC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
IRAK4 Q9NWZ3 4/20 0.37
CYP2C9 P11712 3/20 0.36
CBX7 O95931 2/20 0.36
CDYL2 Q8N8U2 2/20 0.36
CDYL Q9Y232 2/20 0.36
CDY1; CDY1B Q9Y6F8 1/20 0.35
ACHE P22303 1/20 0.35
TP53 P04637 1/20 0.34
SMO Q99835 1/20 0.33
SCD5 Q86SK9 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
RBP4 P02753 1/20 0.33
MAPT P10636 1/20 0.33
MTOR P42345 1/20 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
SCHEMBL4875205 0.91 IRAK4 (0.36) POLBGAATSHRIRAK4CYP2C9
SCHEMBL4874416 0.90 TRPV4 (0.40) POLBGAATSHRIRAK4
SCHEMBL4877296 0.89 GAA (0.40) POLBGAATSHRIRAK4CYP2C9
SCHEMBL4878287 0.88 POLB (0.41) POLBGAATSHRCYP2C9CBX7
SCHEMBL4878078 0.88 GAA (0.39) POLBGAATSHRIRAK4CYP2C9
SCHEMBL4876791 0.88 GAA (0.39) POLBGAATSHRIRAK4CYP2C9
SCHEMBL4867012 0.87 ACHE (0.36) POLBGAATSHRIRAK4CYP2C9
SCHEMBL4877328 0.87 POLB (0.40) POLBGAATSHRCYP2C9CBX7
SCHEMBL4872070 0.86 POLB (0.42) POLBGAATSHRIRAK4CYP2C9
SCHEMBL4870801 0.86 CBX7 (0.39) POLBGAATSHRIRAK4CBX7

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-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 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-20080051384-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 POLB 327/4885GAA 66/4885TSHR 4492/4885

“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.