SCHEMBL10161179

SCHEMBL10161179

CCN1CCC(c2ccc(N3CCN(CC)CC3C)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.47
DRD2 P14416 6/20 0.41
DRD4 P21917 2/20 0.37
DRD3 P35462 2/20 0.36
DRD1 P21728 1/20 0.36
DRD5 P21918 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
SCHEMBL10132281 0.81 MAPK1 (0.51) MAPK1DRD2DRD4
SCHEMBL15859012 0.80 MAPK1 (0.50) MAPK1DRD2DRD4
SCHEMBL18948460 0.80 MAPK1 (0.50) MAPK1DRD2DRD4
SCHEMBL10162449 0.80 GAA (0.56) DRD2
SCHEMBL16549649 0.80 MAPK1 (0.69) MAPK1DRD2DRD4
SCHEMBL15787899 0.78 MAPK1 (0.48) MAPK1DRD2DRD4
SCHEMBL12126936 0.78 KDM4E (0.52) MAPK1DRD2DRD3
SCHEMBL10162628 0.77 KMT2A (0.46) DRD2DRD4DRD3DRD1DRD5
SCHEMBL10162738 0.77 KMT2A (0.46) DRD2DRD4DRD3DRD1DRD5
SCHEMBL10161180 0.76 ESR1 (0.45) DRD2

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-20120165320-A1 NOVEL AZABICYCLOHEXANES PANACEA BIOTEC LTD. (IN) 2012-06-28 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-20120165320-A1 NOVEL AZABICYCLOHEXANES CYP3A43, UGT1A1, CYP3A4 MAPK1 3137/4885DRD2 834/4885DRD4 499/4885

“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.