SCHEMBL3616201

SCHEMBL3616201

CN(C(=O)OC(C)(C)C)C1C2CNCC21

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ASGR1 P07306 1/20 0.41
HSD11B1 P28845 1/20 0.34
SSTR4 P31391 1/20 0.31
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
BRD4 O60885 1/20 0.30
CREBBP Q92793 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
SCHEMBL9178984 1.00 ASGR1 (0.41) ASGR1HSD11B1SSTR4NFKB1NFKB2
SCHEMBL31633856 1.00 ASGR1 (0.41) ASGR1HSD11B1SSTR4NFKB1NFKB2
SCHEMBL5438279 0.83 ASGR1 (0.39) ASGR1HSD11B1
SCHEMBL785468 0.81 HSD11B1 (0.41) ASGR1HSD11B1NFKB1NFKB2RELA
Hydrochloric Acid SCHEMBL2401902 0.80 HSD11B1 (0.40) ASGR1HSD11B1NFKB1NFKB2RELA
SCHEMBL22236163 0.79 CHRNB2 (0.37) SSTR4
SCHEMBL14428327 0.79 HSD11B1 (0.42) ASGR1HSD11B1NFKB1NFKB2RELA
SCHEMBL2092023 0.78 HSD11B1 (0.35) ASGR1HSD11B1SSTR4
SCHEMBL25282846 0.77 ASGR1 (0.37) ASGR1HSD11B1
SCHEMBL22138095 0.77 ASGR1 (0.37) ASGR1HSD11B1

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
US-20100016400-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2010-01-21 US disclosed
EP-1828174-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2007-09-05 EP disclosed
WO-2006054162-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-05-26 WO 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-20100016400-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS CHRM3, CHRM5, CHRM2 ASGR1 253/4885HSD11B1 1683/4885SSTR4 587/4885

“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.