SCHEMBL4878071

SCHEMBL4878071

O=C(O)c1cc2c(s1)c(C1CCCCC1)c(-c1ccc3nc(-c4ccc(F)c(F)c4)ccc3c1)n2CC(=O)N1CCC(N2CCCC2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
GAA P10253 2/20 0.35
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.35
CBX7 O95931 2/20 0.34
CDYL2 Q8N8U2 2/20 0.34
CDYL Q9Y232 2/20 0.34
ALDH1A1 P00352 2/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CDY1; CDY1B Q9Y6F8 1/20 0.34
GRIN2B Q13224 3/20 0.33
MAPT P10636 2/20 0.33
IRAK4 Q9NWZ3 2/20 0.32
SMO Q99835 1/20 0.32
CYP2C9 P11712 1/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
GRIN1 Q05586 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL4877285 0.93 MAPT (0.36) TP53GAAPOLBTSHRCBX7
SCHEMBL4876782 0.92 GAA (0.37) TP53GAAPOLBTSHRCBX7
SCHEMBL4877463 0.91 GAA (0.36) TP53GAAPOLBTSHRCBX7
SCHEMBL4872058 0.90 GAA (0.40) TP53GAAPOLBTSHRCBX7
SCHEMBL4878078 0.89 GAA (0.39) TP53GAAPOLBTSHRCBX7
SCHEMBL4874410 0.89 TRPV4 (0.38) GAAPOLBTSHRGRIN2BIRAK4
SCHEMBL4872438 0.89 TSHR (0.37) TP53GAAPOLBTSHRCBX7
SCHEMBL4877158 0.88 PIK3CA (0.40) TP53GAAPOLBTSHRCBX7
SCHEMBL4867002 0.88 IRAK4 (0.35) TP53GAAPOLBTSHRCBX7
SCHEMBL4875205 0.87 IRAK4 (0.36) TP53GAAPOLBTSHRCBX7

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-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed
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 TP53 3049/4885GAA 66/4885POLB 327/4885

“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.