SCHEMBL5238160

SCHEMBL5238160

CN1CCC[C@H]1COc1cccc([N+](=O)[O-])c1CN

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CHRNB4 P30926 7/20 0.57
▸ CHRNA3 P32297 7/20 0.57
▸ CHRNB2 P17787 3/20 0.50
▸ CHRNB1 P11230 2/20 0.50
▸ CHRNB3 Q05901 2/20 0.50
▸ CHRNA4 P43681 2/20 0.50

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
SCHEMBL6203979 1.00 CHRNB4 (0.57) CHRNB4CHRNA3CHRNB2CHRNB1CHRNB3
SCHEMBL5240331 0.82 CHRNB4 (0.57) CHRNB4CHRNA3CHRNB2CHRNB1CHRNB3
SCHEMBL6205627 0.82 CHRNB4 (0.57) CHRNB4CHRNA3CHRNB2CHRNB1CHRNB3
SCHEMBL5238675 0.81 CHRNB4 (0.60) CHRNB4CHRNA3CHRNB2CHRNB1CHRNB3
SCHEMBL6203538 0.81 CHRNB4 (0.60) CHRNB4CHRNA3CHRNB2CHRNB1CHRNB3
SCHEMBL22106451 0.79 CHRNB4 (0.54) CHRNB4CHRNA3CHRNB2CHRNB1CHRNB3
SCHEMBL5239389 0.76 CHRNB4 (0.64) CHRNB4CHRNA3CHRNB2CHRNB1CHRNB3
SCHEMBL9241457 0.73 CHRNB4 (1.00) CHRNB4CHRNA3CHRNB2CHRNB1CHRNB3
SCHEMBL9238572 0.73 CHRNB4 (1.00) CHRNB4CHRNA3CHRNB2CHRNB1CHRNB3
SCHEMBL9238568 0.73 CHRNB4 (1.00) CHRNB4CHRNA3CHRNB2CHRNB1CHRNB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1507776-B1 2-OXO-1,3,4-TRIHYDROQUINAZOLINYL DERIVATIVES FOR THE TREATMENT OF CELL PROLIFERATION-RELATED DISORDERS AMGEN INC (US) 2007-02-28 — — EP disclosed
US-7119111-B2 2-oxo-1,3,4-trihydroquinazolinyl derivatives and methods of use AMGEN, INC. (US) 2006-10-10 — — US disclosed
US-20030229068-A1 2-oxo-1,3,4-trihydroquinazolinyl derivatives and methods of use AMGEN INC. 2003-12-11 — — 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-20030229068-A1 2-oxo-1,3,4-trihydroquinazolinyl derivatives and methods of use CASP3, BAX, BAD CHRNB4 4173/4885CHRNA3 4021/4885CHRNB2 4019/4885

“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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