SCHEMBL30928610

SCHEMBL30928610

CC1(C)OB(c2ccc3nn(CF)cc3c2)OC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.39
TDO2 P48775 1/20 0.39
LPL P06858 9/20 0.38
LIPG Q9Y5X9 9/20 0.38
FFAR1 O14842 1/20 0.37
SNCA P37840 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
EGFR P00533 2/20 0.35
ROCK1 Q13464 1/20 0.34
ESR2 Q92731 1/20 0.34
F11 P03951 1/20 0.33
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33

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
SCHEMBL17113584 0.88 LPL (0.41) IDO1TDO2LPLLIPGFFAR1
SCHEMBL31394025 0.86 IDO1 (0.39) IDO1TDO2LPLLIPGFFAR1
SCHEMBL31394882 0.85 LPL (0.43) IDO1TDO2LPLLIPGFFAR1
SCHEMBL23633173 0.84 LPL (0.36) IDO1TDO2LPLLIPGFFAR1
SCHEMBL23638441 0.84 FFAR1 (0.39) IDO1TDO2LPLLIPGFFAR1
SCHEMBL30041230 0.83 ESR2 (0.40) IDO1TDO2LPLLIPGFFAR1
SCHEMBL23546464 0.82 LPL (0.35) IDO1TDO2LPLLIPGFFAR1
SCHEMBL5076837 0.82 LIPG (0.42) IDO1TDO2LPLLIPGPRMT5
SCHEMBL23529729 0.82 SNCA (0.38) IDO1TDO2LPLLIPGFFAR1
SCHEMBL17673631 0.82 SNCA (0.36) IDO1TDO2LPLLIPGFFAR1

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-20240182460-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PETRA PHARMA CORPORATION 2024-06-06 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-20240182460-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PIK3CA, PIK3R4, PIK3R5 IDO1 3270/4885TDO2 2897/4885LPL 1668/4885

“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.