SCHEMBL18239357

SCHEMBL18239357

CC1(C)OB(c2ccc3ccn(Cc4ccccc4)c3c2)OC1(C)C

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.48
BRD4 O60885 3/20 0.47
APP P05067 3/20 0.44
SNCA P37840 3/20 0.44
LIPG Q9Y5X9 5/20 0.44
LPL P06858 4/20 0.44
IRAK4 Q9NWZ3 1/20 0.42
BACE1 P56817 1/20 0.41
DGAT1 O75907 1/20 0.37

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
SCHEMBL2240402 0.90 APP (0.44) HTR6BRD4APPSNCALIPG
SCHEMBL17052505 0.89 IRAK4 (0.41) HTR6BRD4LIPGLPLIRAK4
SCHEMBL14764906 0.84 KCNQ3 (0.42) HTR6BRD4LIPGLPLIRAK4
SCHEMBL12260754 0.84 HTR6 (0.55) HTR6LIPGLPL
SCHEMBL8250873 0.83 BRD4 (0.42) BRD4SNCALIPGLPLIRAK4
SCHEMBL18230142 0.82 IRAK4 (0.43) LIPGLPLIRAK4
SCHEMBL18239698 0.80 LPL (0.44) LIPGLPLIRAK4
SCHEMBL3288256 0.79 MAPK14 (0.47) LIPGLPL
SCHEMBL17149343 0.79 HDAC8 (0.46) HTR6LIPGLPLIRAK4
SCHEMBL15333687 0.78 CYP11B1 (0.52) BRD4LIPGLPL

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 4 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
WO-2016180536-A1 SUBSTITUTED QUINOXALINE DERIVATIVES SELVITA S.A. (PL) 2016-11-17 WO 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 HTR6 2563/4885BRD4 127/4885APP 4554/4885

“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.