SCHEMBL16631712

SCHEMBL16631712

Cc1cc(C)c2cc(C)c(=S)nc-2[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.39
MAPT P10636 4/20 0.39
HAVCR2 Q8TDQ0 1/20 0.35
GAA P10253 4/20 0.33
LMNA P02545 2/20 0.33
NR1I3 Q14994 1/20 0.33
ALDH1A1 P00352 5/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
LPO P22079 1/20 0.31
PTGS1 P23219 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HPGD P15428 2/20 0.30
RECQL P46063 1/20 0.30
HSD17B10 Q99714 1/20 0.30
POLB P06746 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
HPGDS O60760 1/20 0.30
DCUN1D1 Q96GG9 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
SCHEMBL16631716 0.84 KDM4E (0.36) KDM4EMAPTGAALMNANR1I3
SCHEMBL16631722 0.81 MGAM (0.30) KDM4EMAPTGAA
SCHEMBL16631413 0.77 MAPT (0.35) KDM4EMAPTGAAALDH1A1SMN1; SMN2
SCHEMBL18081948 0.76 L3MBTL1 (0.35) KDM4EMAPTL3MBTL1
SCHEMBL18081969 0.73 L3MBTL1 (0.33) MAPTL3MBTL1
SCHEMBL16631704 0.73 AMY1A (0.35) GAAL3MBTL1
SCHEMBL16631714 0.73 MGAM (0.33) GAA
SCHEMBL18081951 0.72 NR1I3 (0.45) KDM4EMAPTGAANR1I3ALDH1A1
SCHEMBL16631703 0.72
SCHEMBL18081788 0.72 L3MBTL1 (0.33) MAPTL3MBTL1

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 2 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
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 KDM4E 4689/4885MAPT 3290/4885HAVCR2 1360/4885

“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.