SCHEMBL4885282

SCHEMBL4885282

CC1C2C(COC(=O)Cc3cccc(C4CCCC4)c3O)C2CN1Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.42
DRD3 P35462 10/20 0.42
VEGFA P15692 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
DRD1 P21728 6/20 0.32
MAPT P10636 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NAAA Q02083 1/20 0.32

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
SCHEMBL4885118 0.99 DRD2 (0.41) DRD2DRD3VEGFAEGLN1DRD1
SCHEMBL4179654 0.81 BCHE (0.38) DRD2DRD3MEN1KMT2A
SCHEMBL3205175 0.80 BCHE (0.37) NAAA
SCHEMBL3217075 0.80 BCHE (0.37) NAAA
SCHEMBL4618354 0.76 NAAA (0.38) NAAA
SCHEMBL4885818 0.75 NAAA (0.36) DRD3DRD1NAAA
SCHEMBL3201464 0.75 NAAA (0.36) MEN1KMT2ANAAA
SCHEMBL3222108 0.75 NAAA (0.36) MEN1KMT2ANAAA
SCHEMBL3224062 0.73 NAAA (0.34) MAPTNAAA
SCHEMBL4884661 0.73 SIGMAR1 (0.33) NAAA

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-20080319043-A1 3,6-Disubstituted Azabicyclo (3.1.0) Hexane Derivatives as Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-12-25 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-20080319043-A1 3,6-Disubstituted Azabicyclo (3.1.0) Hexane Derivatives as Muscarinic Receptor Antagonists CHRM3, CHRM5, CHRM2 DRD2 308/4885DRD3 392/4885VEGFA 4818/4885

“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.