SCHEMBL5596885

SCHEMBL5596885

Brc1cc2c3c(cncc3c1)CCN2CC1CCC2(CC1)OCCO2

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.31
STAT3 P40763 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL5596755 0.83 NOTUM (0.32) NOTUM
SCHEMBL5596988 0.82 STAT3 (0.32) STAT3HTTSMN1; SMN2
SCHEMBL5597035 0.82 NOTUM (0.34) NOTUM
SCHEMBL5596965 0.82 NOTUM (0.34) NOTUM
SCHEMBL5597183 0.80
SCHEMBL5596666 0.80 NOTUM (0.33) NOTUM
SCHEMBL5596868 0.76
SCHEMBL5596683 0.69 C5AR1 (0.35) NOTUM
SCHEMBL5597041 0.67 PARP1 (0.36) SMN1; SMN2
SCHEMBL5597142 0.65 PARP1 (0.32) STAT3HTTSMN1; SMN2

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
EP-1829876-A1 NITROGENEOUS TRICYCLIC COMPOUND Asahi Kasei Pharma Corporation (JP) 2007-09-05 EP disclosed
US-20060247266-A1 Nitrogen-containing tricyclic compounds ASAHI KASEI PHARMA CORPORATION (JP) 2006-11-02 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-20060247266-A1 Nitrogen-containing tricyclic compounds MYO1B, CHRM1, MYL12A NOTUM 4510/4885STAT3 516/4885HTT 2750/4885

“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.