SCHEMBL16631823

SCHEMBL16631823

O=c1cc(F)c([C@@H]2O[C@H](CO)C(O)[C@@H]2O)c(F)[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYNJ2 O15056 1/20 0.42
KDM4E B2RXH2 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MGAM O43451 1/20 0.40
GUSB P08236 1/20 0.40
MMP9 P14780 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ALPI P09923 1/20 0.40
ALPG P10696 1/20 0.40
HPGD P15428 1/20 0.40
APEX1 P27695 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CYP1A2 P05177 2/20 0.40
GMNN O75496 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40

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
SCHEMBL16631249 0.89 CDA (0.38) SYNJ2KDM4EMGAMGUSBMMP9
SCHEMBL16631826 0.86 SYNJ2 (0.46) SYNJ2KDM4EL3MBTL1MGAMGUSB
SCHEMBL16631821 0.85 TNF (0.37) SYNJ2LMNATSHRSLC5A2SLC5A1
SCHEMBL16631241 0.83 SYNJ2 (0.38) SYNJ2KDM4EL3MBTL1MGAMGUSB
SCHEMBL16631255 0.81 SYNJ2 (0.39) SYNJ2KDM4EL3MBTL1MGAMGUSB
SCHEMBL16631251 0.76 CDA (0.37) SYNJ2KDM4EALDH1A1LMNATSHR
SCHEMBL18079936 0.76 P2RY2 (0.53) B4GALT1P2RY14
SCHEMBL16781790 0.76 SLC28A1 (0.46) SLC5A2SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL16805391 0.76 SLC28A1 (0.46) SLC5A2SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL16631263 0.76 SLC28A1 (0.46) SLC5A2SLC28A1SLC28A2SLC29A1SLC28A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC. (US) 2016-09-15 US disclosed
US-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC. (US) 2016-09-15 US disclosed
WO-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 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 (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-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF POLRMT, POLN, NSUN3 SYNJ2 642/4885KDM4E 4689/4885L3MBTL1 659/4885

“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.