SCHEMBL13617540

SCHEMBL13617540

N/C(=N\O)c1cccc2c1Oc1ccccc1/C2=C1/C[C@H]2CC[C@@H](C1)N2

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
GFER P55789 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SETD7 Q8WTS6 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
SCHEMBL13617534 1.00 MAPT (0.32) MAPTHTTGFERSMN1; SMN2SETD7
SCHEMBL13617489 1.00 MAPT (0.32) MAPTHTTGFERSMN1; SMN2SETD7
SCHEMBL3380170 1.00 MAPT (0.32) MAPTHTTGFERSMN1; SMN2SETD7
SCHEMBL3382259 0.86 TRPA1 (0.40)
SCHEMBL3384341 0.83 CHRNA7 (0.36) MAPTSETD7
SCHEMBL3380168 0.80 SETD7 (0.30) SETD7
SCHEMBL3381668 0.80 SETD7 (0.35) SETD7
SCHEMBL3383083 0.80 SETD7 (0.35) SETD7
SCHEMBL3385842 0.79 MEN1 (0.36) SMN1; SMN2SETD7
SCHEMBL3384775 0.79 BRD4 (0.37) SETD7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275610-A1 TRICYCLIC OPIOID MODULATORS DECORTE BART 2009-11-05 US disclosed
US-7582650-B2 Tricyclic opioid modulators JANSSEN PHARMACEUTICA N.V. (BE) 2009-09-01 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-20090275610-A1 TRICYCLIC OPIOID MODULATORS OPRD1, OPRM1, OPRK1 MAPT 1747/4885HTT 3367/4885GFER 3252/4885

“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.