SCHEMBL6840682

SCHEMBL6840682

CCOC(=O)C1(NC(C)=O)C=CCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 2/20 0.35
OPRM1 P35372 6/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 2/20 0.32
OPRD1 P41143 3/20 0.32
OPRK1 P41145 3/20 0.32
SLC6A4 P31645 1/20 0.32
ADRA1A P35348 1/20 0.32
KCNH2 Q12809 1/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
SOAT1 P35610 1/20 0.31
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL6840681 1.00 SLC22A1 (0.35) SLC22A1OPRM1SMN1; SMN2ALDH1A1OPRD1
SCHEMBL6841376 0.88
SCHEMBL6841561 0.76 FFAR3 (0.33)
SCHEMBL14838831 0.73 SLC22A1 (0.40) SLC22A1OPRM1SMN1; SMN2ALDH1A1OPRD1
SCHEMBL27188028 0.72 SLC22A1 (0.37) SLC22A1OPRM1SMN1; SMN2ALDH1A1OPRD1
SCHEMBL9782049 0.71 ALDH1A1 (0.41) SLC22A1OPRM1SMN1; SMN2ALDH1A1OPRD1
SCHEMBL29275505 0.69 SLC22A1 (0.37) SLC22A1OPRM1SMN1; SMN2OPRD1OPRK1
SCHEMBL8950840 0.68 SMN1; SMN2 (0.40) SLC22A1OPRM1SMN1; SMN2ALDH1A1OPRD1
SCHEMBL20995886 0.67 SMN1; SMN2 (0.39) SLC22A1OPRM1SMN1; SMN2ALDH1A1OPRD1
SCHEMBL27800390 0.66 SMN1; SMN2 (0.38) SLC22A1OPRM1SMN1; SMN2OPRD1OPRK1

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-20040167351-A1 Method for preparing (1R,4S)-2-azabicyclo[2.2.1]hept-5-ene-3-one derivatives BERNEGGER-EGLI CHRISTINE (CH) 2004-08-26 US claimed
US-20040167351-A1 Method for preparing (1R,4S)-2-azabicyclo[2.2.1]hept-5-ene-3-one derivatives BERNEGGER-EGLI CHRISTINE (CH) 2004-08-26 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-20040167351-A1 Method for preparing (1R,4S)-2-azabicyclo[2.2.1]hept-5-ene-3-one derivatives APEH, CYP51A1, CYP8B1 SLC22A1 3567/4885OPRM1 3316/4885SMN1; SMN2 2852/4885

“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.