SCHEMBL18503446

SCHEMBL18503446

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nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TK2 O00142 5/20 0.46
TSHR P16473 1/20 0.46
MAPT P10636 1/20 0.46
PMP22 Q01453 1/20 0.46
HBB P68871 1/20 0.46
P2RY6 Q15077 2/20 0.43
P2RY14 Q15391 2/20 0.43
NT5E P21589 1/20 0.43
PYGM P11217 3/20 0.41
TYMP P19971 1/20 0.41

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
SCHEMBL17198346 0.90 P2RY6 (0.46) LMNASMN1; SMN2TK2TSHRMAPT
SCHEMBL6536580 0.89 LMNA (0.51) LMNASMN1; SMN2TK2TSHRMAPT
SCHEMBL18503453 0.88 TK2 (0.59) LMNATK2TYMP
SCHEMBL7806784 0.86 TK2 (0.54) LMNASMN1; SMN2TK2TSHRMAPT
SCHEMBL10895353 0.85 LMNA (0.56) LMNASMN1; SMN2TK2TSHRMAPT
SCHEMBL18503429 0.83 P2RY6 (0.51) P2RY6P2RY14NT5E
SCHEMBL18503443 0.82 SLC28A1 (0.57) LMNASMN1; SMN2P2RY6P2RY14
SCHEMBL1055675 0.81 LMNA (0.58) LMNASMN1; SMN2TSHRMAPTPMP22
SCHEMBL2583193 0.81 LMNA (0.58) LMNASMN1; SMN2TSHRMAPTPMP22
SCHEMBL18503498 0.81 P2RY6 (0.38) LMNASMN1; SMN2TK2TSHRMAPT

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-20170044205-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES NUCLEOTIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. 2017-02-16 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-20170044205-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES NUCLEOTIDES FOR THE TREATMENT OF HCV RB1, NSUN2, METTL3 LMNA 1072/4885SMN1; SMN2 166/4885TK2 83/4885

“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.