SCHEMBL784497

SCHEMBL784497

COC(=O)C(C(=O)c1ncccc1O)c1cc(F)c(F)c(F)c1C

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
TLR7 Q9NYK1 5/20 0.35
L3MBTL1 Q9Y468 4/20 0.35
ACLY P53396 1/20 0.35
BRD4 O60885 2/20 0.34
EGLN2 Q96KS0 1/20 0.34
FTO Q9C0B1 1/20 0.34
CTSA P10619 1/20 0.33
GRM4 Q14833 2/20 0.33
KDM4E B2RXH2 2/20 0.33
NPC1 O15118 1/20 0.32
ALOX12 P18054 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
SCHEMBL2012473 0.82 BRD4 (0.36) ALDH1A1L3MBTL1ACLYBRD4CTSA
SCHEMBL783874 0.75 TLR7 (0.42) ALDH1A1TLR7EGLN2FTO
SCHEMBL12631174 0.72 TLR7 (0.48) ALDH1A1TLR7L3MBTL1
SCHEMBL108876 0.67 L3MBTL1 (0.62) ALDH1A1TLR7L3MBTL1BRD4EGLN2
Hydrochloric Acid SCHEMBL6569637 0.66 L3MBTL1 (0.60) ALDH1A1TLR7L3MBTL1BRD4EGLN2
SCHEMBL2009099 0.64 NFE2L2 (0.42) ALDH1A1
SCHEMBL19726555 0.64 EGLN2 (0.47) ALDH1A1TLR7L3MBTL1EGLN2FTO
SCHEMBL1894516 0.64 TLR7 (0.43) ALDH1A1TLR7L3MBTL1BRD4EGLN2
SCHEMBL1921253 0.64 FTO (0.49) ALDH1A1TLR7L3MBTL1EGLN2FTO
SCHEMBL1921252 0.64 FTO (0.49) ALDH1A1TLR7L3MBTL1EGLN2FTO

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-20120071322-A1 Substituted Pyridopyrazines with a Herbicidal Action BASF SE (DE) 2012-03-22 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-20120071322-A1 Substituted Pyridopyrazines with a Herbicidal Action PLPBP, PNPO, PFAS ALDH1A1 313/4885TLR7 4215/4885L3MBTL1 3042/4885

“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.