SCHEMBL933244

SCHEMBL933244

CC(C)(CCCO)C(O)=S

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.35
CA1 P00915 5/20 0.34
CA2 P00918 5/20 0.34
CA12 O43570 3/20 0.34
CA9 Q16790 3/20 0.34
LMNA P02545 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.33
ACLY P53396 1/20 0.31
ACACB O00763 1/20 0.30
ACACA Q13085 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
SCHEMBL9324298 0.86 ACLY (0.39) CYP4F2CYP4A11ALDH1A1ACLYACACB
SCHEMBL9322440 0.83 ACLY (0.43) CYP4F2CYP4A11ACLYACACBACACA
SCHEMBL29135457 0.83
SCHEMBL9785092 0.79 FDPS (0.33) CA1CA2CA12CA9LMNA
SCHEMBL9099589 0.75 CES2 (0.42) TSHR
SCHEMBL5076633 0.75 CES2 (0.42) TSHR
SCHEMBL5075315 0.74 ACLY (0.56) CYP4F2CYP4A11SMN1; SMN2TSHRACLY
SCHEMBL28809593 0.74 CYP4F2 (0.41) CYP4F2CYP4A11SMN1; SMN2LMNAALDH1A1
SCHEMBL11108272 0.72
SCHEMBL9837397 0.72 ACLY (0.54) CYP4F2CYP4A11SMN1; SMN2TSHRACLY

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10307434-B2 Nucleic acid prodrugs and methods of use thereof WAVE LIFE SCIENCES LTD. (SG) 2019-06-04 US disclosed
US-9744183-B2 Nucleic acid prodrugs and methods of use thereof WAVE LIFE SCIENCES LTD. (SG) 2017-08-29 US disclosed
US-20160347784-A1 NOVEL NUCLEIC ACID PRODRUGS AND METHODS OF USE THEREOF WAVE LIFE SCIENCES PTE. LTD. (SG) 2016-12-01 US disclosed
US-20120316224-A1 NOVEL NUCLEIC ACID PRODRUGS AND METHODS OF USE THEREOF ONTORII, INC (US) 2012-12-13 US disclosed
EP-2451461-A1 NOVEL NUCLEIC ACID PRODRUGS AND METHODS OF USE THEREOF Ontorii, Inc (US) 2012-05-16 EP disclosed
WO-2011005761-A1 NOVEL NUCLEIC ACID PRODRUGS AND METHODS USE THEREOF ONTORII, INC (US) 2011-01-13 WO 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 (3 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-20120316224-A1 NOVEL NUCLEIC ACID PRODRUGS AND METHODS OF USE THEREOF PNP, RNGTT, TYMP CYP4F2 1517/4885CYP4A11 910/4885SMN1; SMN2 1649/4885
US-20160347784-A1 NOVEL NUCLEIC ACID PRODRUGS AND METHODS OF USE THEREOF PNP, RNGTT, TYMP CYP4F2 1517/4885CYP4A11 910/4885SMN1; SMN2 1649/4885
US-10307434-B2 Nucleic acid prodrugs and methods of use thereof PNP, RNGTT, NSUN2 CYP4F2 1525/4885CYP4A11 966/4885SMN1; SMN2 1357/4885

“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.