SCHEMBL10085238

SCHEMBL10085238

CC(C)(C)OC(=O)Nc1nc(Cl)nc2c1[nH]c(=O)n2Cc1ccc(C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 15/20 0.49
YTHDC1 Q96MU7 1/20 0.43
NUDT1 P36639 1/20 0.41
BRD4 O60885 1/20 0.39
P2RX7 Q99572 1/20 0.39
IL6 P05231 1/20 0.38
TLR8 Q9NR97 1/20 0.38

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
SCHEMBL10085239 0.85 NUDT1 (0.63) TLR7NUDT1IL6
SCHEMBL823233 0.79 TLR7 (0.48) TLR7YTHDC1NUDT1
SCHEMBL14944669 0.73 BRD4 (0.48) TLR7YTHDC1BRD4P2RX7
SCHEMBL14944672 0.72 BRD4 (0.44) TLR7YTHDC1BRD4P2RX7
SCHEMBL10085237 0.67 EGLN2 (0.37) YTHDC1BRD4
SCHEMBL3495412 0.66 BRD4 (0.48) TLR7BRD4P2RX7
SCHEMBL29997135 0.65 TLR7 (0.82) TLR7NUDT1IL6
SCHEMBL43878 0.65 TLR7 (0.82) TLR7NUDT1IL6
SCHEMBL18207825 0.65 TLR7 (0.43) TLR7TLR8
SCHEMBL2913478 0.64 TLR7 (0.74) TLR7NUDT1TLR8

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-20120009247-A1 PHOSPHOLIPID DRUG ANALOGS BIOPHARMA CREDIT PLC (GB) 2012-01-12 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-20120009247-A1 PHOSPHOLIPID DRUG ANALOGS PHOSPHO1, PXMP4, SGMS1 TLR7 1935/4885YTHDC1 4672/4885NUDT1 1425/4885

“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.