SCHEMBL1176

SCHEMBL1176

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nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.47
CHRM1 P11229 1/20 0.47
TBXA2R P21731 1/20 0.47
ADRA1A P35348 1/20 0.47
FFAR1 O14842 1/20 0.33
CPT2 P23786 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 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
Mevalonic Acid SCHEMBL18376074 0.79 HMGCR (0.67) HMGCRCHRM1TBXA2RADRA1AFFAR1
Mevalonic Acid SCHEMBL120275 0.79 HMGCR (0.67) HMGCRCHRM1TBXA2RADRA1AFFAR1
Mevalonic Acid SCHEMBL120276 0.79 HMGCR (0.67) HMGCRCHRM1TBXA2RADRA1AFFAR1
Mevalonic Acid SCHEMBL8854071 0.79 HMGCR (0.67) HMGCRCHRM1TBXA2RADRA1AFFAR1
SCHEMBL15703179 0.78 HMGCR (0.38) HMGCRCHRM1TBXA2RADRA1AFFAR1
Mevalonic Acid SCHEMBL30657480 0.77 HMGCR (0.64) HMGCRCHRM1TBXA2RADRA1AFFAR1
Mevalonic Acid SCHEMBL29654223 0.77 HMGCR (0.64) HMGCRCHRM1TBXA2RADRA1AFFAR1
Mevalonic Acid SCHEMBL28016589 0.77 HMGCR (0.64) HMGCRCHRM1TBXA2RADRA1AFFAR1
Mevalonic Acid SCHEMBL31294828 0.77 HMGCR (0.64) HMGCRCHRM1TBXA2RADRA1AFFAR1
Mevalonic Acid SCHEMBL28016588 0.77 HMGCR (0.64) HMGCRCHRM1TBXA2RADRA1AFFAR1

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-20120093922-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING EPA AND A CARDIOVASCULAR AGENT AND METHODS OF USING THE SAME AMARIN CORPORATION PLC (IE) 2012-04-19 US disclosed
EP-2424521-A2 PHARMACEUTICAL COMPOSITIONS COMPRISING EPA AND A CARDIOVASCULAR AGENT AND METHODS OF USING THE SAME Amarin Corporation PLC (IE) 2012-03-07 EP 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-20120093922-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING EPA AND A CARDIOVASCULAR AGENT AND METHODS OF USING THE SAME ALOX5, PTGER1, PPARA HMGCR 52/4885CHRM1 3718/4885TBXA2R 16/4885

“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.