SCHEMBL30129031

SCHEMBL30129031

COc1ccc(B2OC(C)(C)C(C)(C)O2)c(F)c1OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 2/20 0.37
LIPG Q9Y5X9 2/20 0.37
EGFR P00533 2/20 0.35
FPR2 P25090 3/20 0.33
LMNA P02545 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CSF1R P07333 1/20 0.32
HTT P42858 2/20 0.31
CHRM2 P08172 2/20 0.31
OPRK1 P41145 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CYP1A2 P05177 1/20 0.31
SLC6A4 P31645 1/20 0.31
OPRD1 P41143 1/20 0.31
ADORA3 P0DMS8 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
SCHEMBL23692939 1.00 LPL (0.37) LPLLIPGEGFRFPR2LMNA
SCHEMBL30385846 0.88 LPL (0.40) LPLLIPGEGFRCSF1RTUBB1
SCHEMBL20508307 0.88 LPL (0.40) LPLLIPGEGFRCSF1RTUBB1
SCHEMBL21823670 0.87 FPR2 (0.38) LPLLIPGEGFRFPR2SMN1; SMN2
SCHEMBL21918856 0.87 FPR2 (0.37) LPLLIPGEGFRFPR2SMN1; SMN2
SCHEMBL25241856 0.85 LPL (0.38) LPLLIPGEGFR
SCHEMBL21918831 0.84 FPR2 (0.41) LPLLIPGEGFRFPR2LMNA
SCHEMBL15507443 0.84 LPL (0.37) LPLLIPGEGFR
SCHEMBL23538053 0.83 EGFR (0.39) LPLLIPGEGFRCSF1R
SCHEMBL25209269 0.83 LPL (0.36) LPLLIPGEGFRCSF1RKDM4E

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-20220396565-A1 NOVEL HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2022-12-15 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-20220396565-A1 NOVEL HETEROCYCLIC COMPOUNDS MRPL21, F12, MRPS34 LPL 3989/4885LIPG 4596/4885EGFR 2971/4885

“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.