SCHEMBL25530751

SCHEMBL25530751

COC(=O)COCCOCCCNC(=O)CCCCCCCCCCCCCCCCC(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
RECQL P46063 1/20 0.43
EPHX2 P34913 2/20 0.42
TLR2 O60603 1/20 0.38
TLR1 Q15399 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.36
GLP1R P43220 6/20 0.36
HDAC8 Q9BY41 1/20 0.35
CYP3A4 P08684 1/20 0.35
FAAH O00519 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL25530748 0.90 GLP1R (0.44) TSHRRECQLEPHX2TLR2TLR1
SCHEMBL23565968 0.90 TSHR (0.43) TSHRRECQLEPHX2TLR2TLR1
SCHEMBL23051843 0.87 TSHR (0.41) TSHRRECQLEPHX2TLR2TLR1
SCHEMBL23080597 0.87 TSHR (0.46) TSHRRECQLEPHX2SMN1; SMN2GAA
SCHEMBL1509898 0.86 EPHX2 (0.43) TSHRRECQLEPHX2TLR2TLR1
SCHEMBL1509858 0.86 EPHX2 (0.43) TSHRRECQLEPHX2TLR2TLR1
SCHEMBL16538712 0.86 EPHX2 (0.43) TSHRRECQLEPHX2TLR2TLR1
SCHEMBL16539040 0.85 GLP1R (0.44) TSHRRECQLEPHX2TLR2TLR1
SCHEMBL25530749 0.85 TSHR (0.36) TSHRRECQLEPHX2TLR2TLR1
SCHEMBL15196457 0.83 EPHX2 (0.43) TSHRRECQLEPHX2TLR2TLR1

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-20230165932-A1 PCSK9 ANTAGONIST COMPOUNDS MERCK SHARP & DOHME LLC 2023-06-01 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-20230165932-A1 PCSK9 ANTAGONIST COMPOUNDS PCSK9, PCSK7, PCSK6 TSHR 948/4885RECQL 2521/4885EPHX2 2213/4885

“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.