SCHEMBL6508429

SCHEMBL6508429

NC(=O)[C@H]1C[C@@H](O)CN1CC1CCN(C2C3CC4CC(C3)CC2C4)CC1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.35
MAPT P10636 1/20 0.35
USP2 O75604 1/20 0.33
CYP2A13 Q16696 1/20 0.33
CNR2 P34972 2/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
MAPK1 P28482 1/20 0.31
KDM4E B2RXH2 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL6509857 0.80 OGFRL1 (0.35) HSD11B1CNR2MAOAMAOBKDM4E
SCHEMBL13285011 0.74 CNR2 (0.49) HSD11B1CNR2MAOAMAOB
SCHEMBL9906605 0.71 CYP2A13 (0.41) MAPTUSP2CYP2A13MAPK1KDM4E
SCHEMBL5157056 0.70 HSD11B1 (0.53) HSD11B1CNR2
SCHEMBL6502476 0.68 HSD11B1 (0.57) HSD11B1CNR2
SCHEMBL15008914 0.67 CYP2A13 (0.54) HSD11B1MAPTUSP2CYP2A13MAPK1
SCHEMBL25485065 0.66 MAOA (0.40) MAOAMAOB
SCHEMBL6504279 0.66 HSD11B1 (0.51) HSD11B1CNR2
SCHEMBL20158970 0.65 MAOA (0.40) MAOAMAOB
SCHEMBL20158969 0.65 MAOA (0.40) MAOAMAOB

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-20050261290-A1 Novel compounds of proline and morpholine derivatives CHENG HENGMIAO 2005-11-24 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-20050261290-A1 Novel compounds of proline and morpholine derivatives CYP11B1, HSD11B1, CYP11B2 HSD11B1 2/4885MAPT 2038/4885USP2 3806/4885

“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.