SCHEMBL14580751

SCHEMBL14580751

CC(=O)N1CC2(CCN(C3CCC4CCC(CC3)N4C(=O)OCC3CC3)CC2)c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 5/20 0.54
AXL P30530 2/20 0.39
CSNK1D P48730 2/20 0.39
MERTK Q12866 2/20 0.39
SLC18A3 Q16572 2/20 0.39
SIGMAR1 Q99720 1/20 0.39
FGFR1 P11362 1/20 0.37
KDR P35968 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL12999714 0.94 NOTUM (0.52) NOTUMAXLCSNK1DMERTKSLC18A3
SCHEMBL13000700 0.91 NOTUM (0.53) NOTUMSLC18A3SIGMAR1ALDH1A1
SCHEMBL14580769 0.90 NOTUM (0.54) NOTUMAXLCSNK1DMERTKSLC18A3
SCHEMBL14580764 0.89 NOTUM (0.52) NOTUMAXLCSNK1DMERTKSLC18A3
SCHEMBL14580788 0.89 NOTUM (0.52) NOTUMAXLCSNK1DMERTKSLC18A3
SCHEMBL14580786 0.89 NOTUM (0.52) NOTUMAXLCSNK1DMERTKSLC18A3
SCHEMBL14580827 0.88 NOTUM (0.58) NOTUMAXLCSNK1DMERTKSLC18A3
SCHEMBL14580772 0.88 NOTUM (0.51) NOTUMAXLCSNK1DMERTKSLC18A3
SCHEMBL14580845 0.87 NOTUM (0.50) NOTUMAXLCSNK1DMERTKSLC18A3
SCHEMBL12084247 0.86 NOTUM (0.54) NOTUMAXLCSNK1DMERTKALDH1A1

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-20070043023-A1 Modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED 2007-02-22 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-20070043023-A1 Modulators of muscarinic receptors CHRM3, CHRM5, CHRM2 NOTUM 1391/4885AXL 2493/4885CSNK1D 1760/4885

“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.