SCHEMBL12437994

SCHEMBL12437994

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nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.38
CHRM1 P11229 1/20 0.38
TBXA2R P21731 1/20 0.38
ADRA1A P35348 1/20 0.38
MVD P53602 1/20 0.33

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
SCHEMBL12438025 0.84 MVD (0.39) MVD
SCHEMBL12437993 0.82 MVD (0.33) MVD
SCHEMBL12438019 0.80 MVD (0.31) MVD
SCHEMBL12438005 0.76 MVD (0.31) MVD
SCHEMBL12332332 0.74 MVD (0.43) HMGCRCHRM1TBXA2RADRA1AMVD
SCHEMBL599363 0.74 HMGCR (0.50) HMGCRCHRM1TBXA2RADRA1AMVD
SCHEMBL18376075 0.74 HMGCR (0.50) HMGCRCHRM1TBXA2RADRA1AMVD
SCHEMBL1286788 0.74 HMGCR (0.50) HMGCRCHRM1TBXA2RADRA1AMVD
SCHEMBL12438008 0.73 MVD (0.33) MVD
SCHEMBL12437992 0.70 BHMT (0.31)

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-20110178043-A1 Inhibitors of the mevalonate pathway of streptococcus pneumoniae NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-07-21 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-20110178043-A1 Inhibitors of the mevalonate pathway of streptococcus pneumoniae FNTA, GGPS1, HMGCR HMGCR 3/4885CHRM1 4222/4885TBXA2R 3305/4885

“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.