SCHEMBL10130949

SCHEMBL10130949

CCCC(=O)N1CCN(c2ccc(C34CC3CN(CC)C4)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.49
USP2 O75604 1/20 0.45
POLB P06746 1/20 0.44
NAMPT P43490 1/20 0.43
DRD2 P14416 1/20 0.42
DRD3 P35462 1/20 0.42
KCNH2 Q12809 1/20 0.42
MITF O75030 1/20 0.41
HTT P42858 1/20 0.41
PAX8 Q06710 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HTR1A P08908 1/20 0.40
HTR7 P34969 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ADAMTS5 Q9UNA0 1/20 0.40

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
SCHEMBL10130957 0.88 ME2 (0.55) MAPTPOLBHTTSMN1; SMN2NPSR1
SCHEMBL10130944 0.85 TDP1 (0.50) MAPTNAMPTDRD2DRD3KCNH2
SCHEMBL10132306 0.85 MAPT (0.54) MAPTDRD2DRD3KCNH2HTT
SCHEMBL10132304 0.84 KCNH2 (0.42) MAPTDRD2DRD3KCNH2
SCHEMBL10130940 0.84 GAA (0.49) MAPTDRD2DRD3KCNH2SMN1; SMN2
SCHEMBL10132302 0.82 LMNA (0.52) MAPTHTTSMN1; SMN2
SCHEMBL9951699 0.81 CHRNA7 (0.53) MAPTDRD2DRD3KCNH2SMN1; SMN2
SCHEMBL10130858 0.81 KCNH2 (0.47) MAPTDRD2DRD3KCNH2SMN1; SMN2
SCHEMBL10130834 0.81 KCNH2 (0.47) MAPTDRD2DRD3KCNH2SMN1; SMN2
SCHEMBL10130859 0.81 KCNH2 (0.47) MAPTDRD2DRD3KCNH2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8906913-B2 Azabicyclohexanes PANACEA BIOTEC LIMITED (IN) 2014-12-09 US disclosed
US-8906913-B2 Azabicyclohexanes PANACEA BIOTEC LIMITED (IN) 2014-12-09 US disclosed
EP-2445887-B1 NOVEL AZABICYCLOHEXANES PANACEA BIOTEC LTD (IN) 2014-11-05 EP disclosed
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 MAPT 219/4885USP2 3619/4885POLB 1142/4885

“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.