SCHEMBL605247

SCHEMBL605247

COC1COC2(CCCCC2)O1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
GAA P10253 1/20 0.38
HTR1A P08908 3/20 0.35
ADRA1D P25100 3/20 0.35
ADRA1B P35368 3/20 0.35
ADRA1A P35348 2/20 0.35
TMEM97 Q5BJF2 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL12582053 0.75
SCHEMBL27523471 0.75
SCHEMBL7875758 0.75
SCHEMBL29392716 0.72 PABPC1 (0.36) PABPC1CTDSP1GAAHTR1AADRA1D
SCHEMBL9527783 0.72 PABPC1 (0.33) PABPC1CTDSP1GAAHTR1AADRA1D
SCHEMBL3305308 0.71 PABPC1 (0.44) PABPC1CTDSP1GAAHTR1AADRA1D
SCHEMBL12944477 0.71 PABPC1 (0.44) PABPC1CTDSP1GAAHTR1AADRA1D
SCHEMBL12944468 0.71 PABPC1 (0.44) PABPC1CTDSP1GAAHTR1AADRA1D
SCHEMBL10615776 0.70 PABPC1 (0.43) PABPC1CTDSP1GAAHTR1AADRA1D
SCHEMBL3308565 0.69 PABPC1 (0.42) PABPC1CTDSP1GAAHTR1AADRA1D

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-20120041028-A1 BENZIMIDAZOLES WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE GLAXO GROUP LIMITED 2012-02-16 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-20120041028-A1 BENZIMIDAZOLES WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE CHRM1, CHRM2, CHRM4 PABPC1 4451/4885CTDSP1 3052/4885GAA 290/4885

“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.