SCHEMBL16631172

SCHEMBL16631172

Cc1c(F)c([C@@H]2O[C@H](CO)C(O)[C@@H]2F)c[nH]c1=O

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CDA P32320 1/20 0.37
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
OGA O60502 2/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HEXB P07686 1/20 0.33
PNP P00491 5/20 0.33
SLC5A2 P31639 2/20 0.32
SYNJ2 O15056 1/20 0.32
TNF P01375 1/20 0.32
IL6 P05231 1/20 0.32
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL16631836 0.90 PNP (0.41) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL16631818 0.84 PNP (0.35) ALDH1A1MEN1KMT2APNPSLC5A2
SCHEMBL15216151 0.78 CDA (0.39) CDAALDH1A1MEN1KMT2AOGA
SCHEMBL773455 0.78 CDA (0.39) CDAALDH1A1MEN1KMT2AOGA
SCHEMBL767735 0.78 CDA (0.39) CDAALDH1A1MEN1KMT2AOGA
SCHEMBL16631270 0.77 CDA (0.38) CDAOGAHEXBPNPSLC5A2
SCHEMBL16631547 0.76 SLC5A2 (0.42) CDAALDH1A1OGAHEXBSLC5A2
SCHEMBL16631161 0.76 CDA (0.35) CDAALDH1A1MEN1KMT2AOGA
SCHEMBL12642332 0.76 CDA (0.40) CDAALDH1A1MEN1KMT2AOGA
SCHEMBL16631160 0.76 CDA (0.35) CDAALDH1A1MEN1KMT2AOGA

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 CDA 200/4885ALDH1A1 4189/4885MEN1 3881/4885

“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.