SCHEMBL14367298

SCHEMBL14367298

CN1CNC(=O)C12CCN(P)CC2

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 1/20 0.41
CDK19 Q9BWU1 1/20 0.41
SLC6A9 P48067 3/20 0.35
OPRM1 P35372 7/20 0.35
OPRD1 P41143 7/20 0.35
OPRK1 P41145 7/20 0.35
OPRL1 P41146 7/20 0.35

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
SCHEMBL13563372 0.85 CDK8 (0.40) CDK8CDK19SLC6A9OPRM1OPRD1
SCHEMBL18800970 0.80 SLC6A9 (0.38) CDK8CDK19SLC6A9OPRM1OPRD1
SCHEMBL13541903 0.79 OPRM1 (0.45) CDK8CDK19OPRM1OPRD1OPRK1
SCHEMBL16883674 0.77 HSD17B10 (0.51) CDK8CDK19OPRM1OPRD1OPRK1
SCHEMBL4838402 0.72 HSD17B10 (0.35) CDK8CDK19
SCHEMBL12918587 0.72 HSD17B10 (0.35) CDK8CDK19
SCHEMBL9029374 0.71 OPRL1 (0.70) OPRM1OPRD1OPRK1OPRL1
SCHEMBL12121672 0.70 OTUD7B (0.34)
SCHEMBL12895360 0.68 OTUD7B (0.31)
SCHEMBL21216364 0.67 SMN1; SMN2 (0.35) OPRM1OPRD1OPRK1OPRL1

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-20070270433-A1 Thiazolo-pyrimidine/pyridine urea derivatives BRINKMAN JOHN A 2007-11-22 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-20070270433-A1 Thiazolo-pyrimidine/pyridine urea derivatives ADORA2B, UTS2R, TBXA2R CDK8 967/4885CDK19 1498/4885SLC6A9 3090/4885

“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.