SCHEMBL1300764

SCHEMBL1300764

CC(C)C(CO)n1cc(C(=O)O)c(=O)c2cc(Cc3cccc(Cl)c3F)nnc21

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.65
THRB P10828 1/20 0.34
TSHR P16473 1/20 0.34
HIF1A Q16665 1/20 0.34
NOTUM Q6P988 1/20 0.33
CFD P00746 6/20 0.33
NTRK1 P04629 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
CD38 P28907 1/20 0.31
CXCR2 P25025 1/20 0.31

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
SCHEMBL1300777 1.00 METTL3 (0.65) METTL3THRBTSHRHIF1ANOTUM
SCHEMBL12108084 0.87 METTL3 (0.69) METTL3THRBTSHRHIF1ANOTUM
SCHEMBL1301031 0.87 METTL3 (0.64) METTL3THRBTSHRHIF1ANOTUM
SCHEMBL1301034 0.87 METTL3 (0.64) METTL3THRBTSHRHIF1ANOTUM
SCHEMBL1301704 0.86 METTL3 (0.70) METTL3NOTUMCFDNTRK1MRGPRX4
SCHEMBL16302717 0.85 METTL3 (0.66) METTL3THRBTSHRHIF1ACFD
SCHEMBL12108039 0.84 METTL3 (0.65) METTL3THRBTSHRHIF1ANOTUM
SCHEMBL12107926 0.84 METTL3 (0.72) METTL3THRBTSHRHIF1A
SCHEMBL1300623 0.84 METTL3 (0.72) METTL3THRBTSHRHIF1A
SCHEMBL1300379 0.84 METTL3 (0.67) METTL3THRBTSHRHIF1ANOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269741-A1 NOVEL COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2011-11-03 US disclosed
US-20110166123-A1 NOVEL COMPOSITIONS AND METHODS OF USE AARDEA BIOSCIENCES, INC. (US) 2011-07-07 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 (2 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-20110166123-A1 NOVEL COMPOSITIONS AND METHODS OF USE TYMP, SAMHD1, PNP METTL3 2709/4885THRB 4424/4885TSHR 4868/4885
US-20110269741-A1 NOVEL COMPOSITIONS AND METHODS OF USE TYMP, SAMHD1, PNP METTL3 2709/4885THRB 4424/4885TSHR 4868/4885

“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.