SCHEMBL10130749

SCHEMBL10130749

CC(=O)N1CC2CC2(c2ccc(N3C[C@H](CO)OC3=O)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.46
MAOA P21397 1/20 0.46
MGLL Q99685 2/20 0.42
CALML3 P27482 6/20 0.41
SIGMAR1 Q99720 4/20 0.40
GRM2 Q14416 3/20 0.39

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
SCHEMBL10162812 0.88 MAOA (0.48) MAOBMAOACALML3
SCHEMBL9951426 0.88 MAOA (0.48) MAOBMAOACALML3
SCHEMBL10163012 0.88 MAOA (0.48) MAOBMAOACALML3
SCHEMBL10130828 0.86 SIGMAR1 (0.49) SIGMAR1
SCHEMBL9951537 0.86 MAOA (0.41) MAOBMAOAMGLLCALML3SIGMAR1
SCHEMBL10162975 0.85 F10 (0.42) MAOBMAOACALML3SIGMAR1GRM2
SCHEMBL10130826 0.84 MAOA (0.51) MAOBMAOA
SCHEMBL12974049 0.84 F10 (0.41) MAOBMAOACALML3
SCHEMBL10130819 0.83 ITGB3 (0.43) MAOBMAOACALML3
SCHEMBL10163011 0.81 MAOA (0.47) MAOBMAOACALML3

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 5 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
WO-2010150281-A2 NOVEL AZABICYCLOHEXANES PANACEA BIOTEC LTD. (IN) 2010-12-29 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-20120165320-A1 NOVEL AZABICYCLOHEXANES CYP3A43, UGT1A1, CYP3A4 MAOB 227/4885MAOA 673/4885MGLL 4807/4885

“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.