SCHEMBL6745683

SCHEMBL6745683

CNC(=O)Oc1cnc2[nH]cc(CCNC(=O)C3CC3)c2c1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 14/20 0.56
MTNR1B P49286 9/20 0.56
ALDH1A1 P00352 1/20 0.55
SPR P35270 1/20 0.48
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43

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
SCHEMBL5339908 0.82 SPR (0.65) MTNR1AMTNR1BALDH1A1SPRBCHE
SCHEMBL5341340 0.80 MTNR1A (0.56) MTNR1AMTNR1BALDH1A1SPRBCHE
SCHEMBL7021034 0.80 MTNR1A (0.52) MTNR1AMTNR1BALDH1A1SPRBCHE
SCHEMBL5340496 0.79 SPR (0.55) MTNR1AMTNR1BALDH1A1SPRBCHE
SCHEMBL5339464 0.79 SPR (0.55) MTNR1AMTNR1BALDH1A1SPRBCHE
SCHEMBL5335667 0.79 SPR (0.55) MTNR1AMTNR1BALDH1A1SPRBCHE
SCHEMBL6076414 0.78 SPR (0.60) MTNR1AMTNR1BALDH1A1SPRBCHE
SCHEMBL5335786 0.78 SPR (0.49) MTNR1AMTNR1BALDH1A1SPR
SCHEMBL5340177 0.77 MTNR1A (0.55) MTNR1AMTNR1BALDH1A1SPRBCHE
SCHEMBL6218623 0.76 MTNR1A (0.52) MTNR1AMTNR1BALDH1A1SPRBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040002490-A1 Substituted cyclic compounds, preparation method and pharmaceutical compositions containing them LESIEUR DANIEL (FR) 2004-01-01 US claimed
US-20040002491-A1 Substituted cyclic compounds, preparation method and pharmaceutical compositions containing them LESIEUR DANIEL (FR) 2004-01-01 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20040002491-A1 Substituted cyclic compounds, preparation method and pharmaceutical compositions containing them CYP4B1, CYP3A5, MC2R MTNR1A 388/4885MTNR1B 325/4885ALDH1A1 1076/4885
US-20040002490-A1 Substituted cyclic compounds, preparation method and pharmaceutical compositions containing them CYP3A5, CYP4B1, MC2R MTNR1A 409/4885MTNR1B 340/4885ALDH1A1 1209/4885

“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.