SCHEMBL5157950

SCHEMBL5157950

O=C(NC12CC3CC(CC(C3)C1)C2)C1CCCNC1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.61
EPHX2 P34913 8/20 0.49
SLC6A1 P30531 2/20 0.49
SLC6A11 P48066 1/20 0.49
TSHR P16473 1/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
SLC6A13 Q9NSD5 1/20 0.49
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
CYP2D6 P10635 1/20 0.47

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
SCHEMBL2638872 0.83 EPHX2 (0.57) EPHX1EPHX2TSHRKMT2A
SCHEMBL3928986 0.81 EPHX2 (0.61) EPHX1EPHX2
SCHEMBL2638571 0.81 EPHX2 (0.59) EPHX1EPHX2TSHRMAPTKMT2A
SCHEMBL14085442 0.77 EPHX2 (0.68) EPHX1EPHX2
SCHEMBL4542363 0.76 EPHX1 (1.00) EPHX1EPHX2LMNASMN1; SMN2MAPT
SCHEMBL5160032 0.75 EPHX1 (0.51) EPHX1EPHX2TSHRKMT2A
SCHEMBL4827562 0.75 EPHX1 (0.51) EPHX1EPHX2TSHRKMT2A
SCHEMBL17437543 0.75 EPHX1 (0.51) EPHX1EPHX2TSHRKMT2A
SCHEMBL29541898 0.75 SLC6A1 (0.50) EPHX1SLC6A1SLC6A11TSHRLMNA
SCHEMBL29541932 0.74 SLC6A1 (0.49) EPHX1SLC6A1SLC6A11TSHRLMNA

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 EPHX1 810/4885EPHX2 2185/4885SLC6A1 575/4885

“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.