SCHEMBL6504241

SCHEMBL6504241

CCN1CCC(C(=O)O)(c2ccccc2)C1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 7/20 0.65
OPRD1 P41143 6/20 0.65
OPRK1 P41145 6/20 0.65
SLC22A1 O15245 1/20 0.50
SLC6A4 P31645 1/20 0.50
ADRA1A P35348 1/20 0.50
KCNH2 Q12809 1/20 0.50
AKR1C1 Q04828 1/20 0.50
KMT2A Q03164 2/20 0.49
TET3 O43151 1/20 0.49
FBXL19 Q6PCT2 1/20 0.49
CXXC5 Q7LFL8 1/20 0.49
TET1 Q8NFU7 1/20 0.49
KDM2B Q8NHM5 1/20 0.49
CXXC4 Q9H2H0 1/20 0.49
KDM2A Q9Y2K7 1/20 0.49
KCNA3 P22001 1/20 0.48

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
SCHEMBL503892 0.90 OPRM1 (0.73) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL16263190 0.83 OPRL1 (0.56) OPRM1OPRD1OPRK1AKR1C1KMT2A
SCHEMBL8440281 0.83 OPRM1 (0.71) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL17520399 0.81 OPRM1 (0.69) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL8437630 0.81 OPRM1 (0.69) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL6498839 0.80 HSD11B1 (0.63) OPRM1OPRD1OPRK1KMT2ATET3
SCHEMBL9065208 0.79 OPRM1 (0.65) OPRM1OPRD1OPRK1KMT2AKCNA3
SCHEMBL6502637 0.79 KMT2A (0.61) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL11712071 0.79 OPRM1 (1.00) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL680913 0.79 OPRM1 (0.57) OPRM1OPRD1OPRK1SLC22A1SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor MILLENNIUM PHARMACEUTICALS, INC. 2005-06-30 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-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor CCR8, CCL11, CCR5 OPRM1 494/4885OPRD1 565/4885OPRK1 246/4885

“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.