SCHEMBL5157962

SCHEMBL5157962

CN1CCN(CC2CCCC2)[C@@H](C(=O)NC23CC4CC(CC(C4)C2)C3)C1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.46
TSHR P16473 1/20 0.46
KDM4E B2RXH2 1/20 0.45
EPHX1 P07099 9/20 0.44
HSD11B1 P28845 1/20 0.43
ALDH1A1 P00352 3/20 0.42
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 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
SCHEMBL5158943 0.84 TSHR (0.57) EPHX2TSHREPHX1HSD11B1ALDH1A1
SCHEMBL6504693 0.81 EPHX1 (0.53) EPHX2TSHREPHX1HSD11B1ALDH1A1
SCHEMBL6502473 0.80 EPHX1 (0.46) EPHX2TSHREPHX1HSD11B1ALDH1A1
SCHEMBL5157050 0.79 EPHX2 (0.44) EPHX2TSHRKDM4EEPHX1HSD11B1
SCHEMBL5157965 0.78 HSD11B1 (0.61) EPHX2EPHX1HSD11B1KMT2A
SCHEMBL5160293 0.70 HSD11B1 (0.55) EPHX2TSHRKDM4EEPHX1HSD11B1
SCHEMBL6508426 0.70 EPHX1 (0.52) EPHX2TSHREPHX1HSD11B1
Hydrochloric Acid SCHEMBL5154837 0.68 HSD11B1 (0.56) EPHX2TSHRKDM4EEPHX1HSD11B1
SCHEMBL6504405 0.68 HSD11B1 (0.53) EPHX2TSHRKDM4EEPHX1HSD11B1
SCHEMBL5157601 0.67 HSD11B1 (0.51) EPHX2TSHRKDM4EEPHX1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1745019-A1 NOVEL COMPOUNDS OF PROLINE AND MORPHOLINE DERIVATIVES PFIZER INC. (US) 2007-01-24 EP disclosed
US-20050261290-A1 Novel compounds of proline and morpholine derivatives CHENG HENGMIAO 2005-11-24 US disclosed
WO-2005108359-A1 NOVEL COMPOUNDS OF PROLINE AND MORPHOLINE DERIVATIVES PFIZER INC. (US) 2005-11-17 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-20050261290-A1 Novel compounds of proline and morpholine derivatives CYP11B1, HSD11B1, CYP11B2 EPHX2 2185/4885TSHR 2376/4885KDM4E 2924/4885

“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.