SCHEMBL12829673

SCHEMBL12829673

CCOC(=O)C1(C)C=C(C)C=CC1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
BRD4 O60885 1/20 0.35
OPRM1 P35372 7/20 0.34
SLC22A1 O15245 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
OPRD1 P41143 3/20 0.33
OPRK1 P41145 3/20 0.33
SLC6A4 P31645 1/20 0.33
ADRA1A P35348 1/20 0.33
KCNH2 Q12809 1/20 0.33
ATM Q13315 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL3775595 0.75 POLB (0.36) POLBBRD4OPRM1SLC22A1SMN1; SMN2
SCHEMBL23421921 0.74
SCHEMBL13157265 0.74 POLB (0.34) POLBBRD4OPRM1SLC22A1SMN1; SMN2
SCHEMBL27509924 0.73 BRD4 (0.38) POLBBRD4OPRM1SLC22A1SMN1; SMN2
SCHEMBL30050431 0.71 POLB (0.39) POLBBRD4OPRM1SLC22A1SMN1; SMN2
SCHEMBL12751319 0.70 BRD4 (0.45) POLBBRD4OPRM1SLC22A1SMN1; SMN2
SCHEMBL23637555 0.68
SCHEMBL609526 0.66 ALDH1A1 (0.40) POLBOPRM1SLC22A1SMN1; SMN2OPRD1
SCHEMBL12354409 0.66 POLB (0.37) POLBBRD4OPRM1SLC22A1SMN1; SMN2
SCHEMBL27800390 0.64 SMN1; SMN2 (0.38) POLBBRD4OPRM1SLC22A1SMN1; SMN2

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-9272260-B2 Methods of synthesis and purification by use of a solid support UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2016-03-01 US disclosed
US-20110077393-A1 METHODS OF SYNTHESIS AND PURIFICATION BY USE OF A SOLID SUPPORT UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION (US) 2011-03-31 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-20110077393-A1 METHODS OF SYNTHESIS AND PURIFICATION BY USE OF A SOLID SUPPORT WASF2, DCXR, RIOX2 POLB 1741/4885BRD4 3465/4885OPRM1 696/4885

“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.