SCHEMBL6508426

SCHEMBL6508426

O=C(NC12CC3CC(CC(C3)C1)C2)[C@H]1C[C@@H](O)CN1CC1CCNCC1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.52
EPHX2 P34913 6/20 0.50
HSD11B1 P28845 1/20 0.38
TSHR P16473 1/20 0.37
CNR2 P34972 2/20 0.36
GBA1 P04062 2/20 0.35
UGCG Q16739 2/20 0.35
GBA2 Q9HCG7 2/20 0.35

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
SCHEMBL6502473 0.89 EPHX1 (0.46) EPHX1EPHX2HSD11B1TSHRCNR2
SCHEMBL5157050 0.85 EPHX2 (0.44) EPHX1EPHX2HSD11B1TSHRCNR2
SCHEMBL6504279 0.79 HSD11B1 (0.51) EPHX1EPHX2HSD11B1CNR2GBA1
SCHEMBL6509853 0.76 EPHX1 (0.43) EPHX1CNR2GBA1
SCHEMBL6504693 0.76 EPHX1 (0.53) EPHX1EPHX2HSD11B1TSHR
SCHEMBL5158943 0.70 TSHR (0.57) EPHX1EPHX2HSD11B1TSHRCNR2
SCHEMBL3928986 0.70 EPHX2 (0.61) EPHX1EPHX2
SCHEMBL5157962 0.70 EPHX2 (0.46) EPHX1EPHX2HSD11B1TSHR
SCHEMBL4535957 0.69 EPHX1 (1.00) EPHX1EPHX2
SCHEMBL4537511 0.67 EPHX1 (0.84) EPHX1EPHX2

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 EPHX1 810/4885EPHX2 2185/4885HSD11B1 2/4885

“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.