SCHEMBL5157293

SCHEMBL5157293

CN(CCN1CCCC1C(=O)NC12CC3CC(CC(C3)C1)C2)Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.56
FKBP1A P62942 8/20 0.48
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
EPHX2 P34913 3/20 0.43
EPHX1 P07099 2/20 0.43
MAPK1 P28482 1/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TSHR P16473 1/20 0.41
CYP2D6 P10635 1/20 0.41

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
SCHEMBL5157285 0.82 HSD11B1 (0.55) HSD11B1ALDH1A1EPHX2SMN1; SMN2CYP2D6
SCHEMBL5160293 0.74 HSD11B1 (0.55) HSD11B1KMT2AALDH1A1EPHX2EPHX1
SCHEMBL8546687 0.73 MAPK1 (0.57) HSD11B1FKBP1AKMT2AALDH1A1MEN1
Hydrochloric Acid SCHEMBL5154837 0.73 HSD11B1 (0.56) HSD11B1FKBP1AKMT2AALDH1A1MEN1
SCHEMBL6504405 0.72 HSD11B1 (0.53) HSD11B1KMT2AALDH1A1EPHX2EPHX1
SCHEMBL5157601 0.70 HSD11B1 (0.51) HSD11B1KMT2AALDH1A1EPHX2EPHX1
SCHEMBL8546685 0.69 HSD11B1 (0.54) HSD11B1FKBP1AKMT2AALDH1A1EPHX2
SCHEMBL8546679 0.69 HSD11B1 (0.54) HSD11B1FKBP1AKMT2AALDH1A1EPHX2
SCHEMBL5158943 0.68 TSHR (0.57) HSD11B1KMT2AALDH1A1MEN1EPHX2
SCHEMBL8544832 0.67 HSD11B1 (0.45) HSD11B1FKBP1AKMT2AALDH1A1MEN1

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 HSD11B1 2/4885FKBP1A 33/4885KMT2A 3470/4885

“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.