SCHEMBL20186944

SCHEMBL20186944

Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c2ccc(B3OC(C)(C)C(C)(C)O3)cc12

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 9/20 0.41
LPL P06858 8/20 0.41
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
CSF1R P07333 1/20 0.33
P4HB P07237 1/20 0.33
ROCK1 Q13464 1/20 0.32
EGFR P00533 1/20 0.32
BACE1 P56817 1/20 0.31
F2 P00734 1/20 0.30
F11 P03951 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 1/20 0.30

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
SCHEMBL18239408 0.77 LPL (0.42) LIPGLPLIDO1TDO2IRAK4
SCHEMBL29856116 0.76 LPL (0.39) LIPGLPLIDO1TDO2IRAK4
SCHEMBL20186942 0.76 LPL (0.39) LIPGLPLIDO1TDO2IRAK4
SCHEMBL3040210 0.76 LPL (0.41) LIPGLPLIDO1TDO2IRAK4
SCHEMBL31636018 0.74 LPL (0.40) LIPGLPLIDO1TDO2IRAK4
SCHEMBL3044285 0.73 LPL (0.41) LIPGLPLIDO1TDO2IRAK4
SCHEMBL26390707 0.72 LPL (0.38) LIPGLPLIDO1TDO2IRAK4
SCHEMBL19564598 0.71 LPL (0.40) LIPGLPLIDO1TDO2IRAK4
SCHEMBL19665906 0.71 LIPG (0.37) LIPGLPLIDO1TDO2IRAK4
SCHEMBL24450016 0.71 HIF1A (0.38) LIPGLPLIDO1TDO2IRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180148429-A1 SUBSTITUTED QUINOXALINE DERIVATIVES SELVITA S.A. (PL) 2018-05-31 US disclosed
US-20180148429-A1 SUBSTITUTED QUINOXALINE DERIVATIVES SELVITA S.A. (PL) 2018-05-31 US disclosed
US-20180148429-A1 SUBSTITUTED QUINOXALINE DERIVATIVES SELVITA S.A. (PL) 2018-05-31 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-20180148429-A1 SUBSTITUTED QUINOXALINE DERIVATIVES BRCA1, NQO2, NQO1 LIPG 2601/4885LPL 4519/4885IDO1 1270/4885

“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.