SCHEMBL20289870

SCHEMBL20289870

CN1C(=O)c2c(ncn2CC(=O)Nc2ccc(-c3ccc(F)cc3)cn2)N(C)C1O

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ WNT3A P56704 1/20 0.43
▸ PORCN Q9H237 1/20 0.40
▸ GRIN2B Q13224 11/20 0.39
▸ GRM5 P41594 2/20 0.38
▸ KDR P35968 1/20 0.38
▸ TEK Q02763 1/20 0.38
▸ MAPK10 P53779 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ MAPK14 Q16539 1/20 0.38

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
SCHEMBL19997369 0.88 PORCN (0.47) WNT3APORCN
SCHEMBL19997380 0.85 WNT3A (0.44) WNT3APORCN
SCHEMBL23416906 0.80 PORCN (0.48) WNT3APORCN
SCHEMBL19626366 0.80 PORCN (0.42) WNT3APORCN
SCHEMBL21935695 0.79 PORCN (0.46) PORCN
SCHEMBL23416909 0.78 PORCN (0.58) WNT3APORCN
SCHEMBL19997367 0.77 DEGS1 (0.41) WNT3A
SCHEMBL19626536 0.77 MAPT (0.47) —
SCHEMBL21413005 0.77 GRM5 (0.37) PORCNGRM5
SCHEMBL19626637 0.76 PORCN (0.51) WNT3APORCN

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-20180170932-A1 PURINE DIONES AS WNT PATHWAY MODULATORS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2018-06-21 — — 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-20180170932-A1 PURINE DIONES AS WNT PATHWAY MODULATORS WNT1, WNT3A, CTNNB1 WNT3A 2/4885PORCN 3761/4885GRIN2B 3689/4885

“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.

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