SCHEMBL16631926

SCHEMBL16631926

Cn1cc2ncc(=O)[nH]c2nc1=S

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4A O75164 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.35
GLA P06280 1/20 0.35
PMP22 Q01453 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPKAPK2 P49137 1/20 0.32
RPS6KA3 P51812 1/20 0.32
CSNK2A1 P68400 1/20 0.32
PLK3 Q9H4B4 1/20 0.32

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
SCHEMBL18081796 0.83 ALDH1A1 (0.37) KDM4EALDH1A1KDM4APOLBMAPT
SCHEMBL18080530 0.80 KDM4E (0.36) KDM4EALDH1A1KDM4APOLBMAPT
SCHEMBL18081819 0.75
SCHEMBL18081943 0.74 NSD2 (0.36) KDM4EALDH1A1MAPTLMNA
SCHEMBL18081938 0.73 PDE3B (0.38) KDM4EALDH1A1
SCHEMBL18081830 0.73 ALDH1A1 (0.30) ALDH1A1
SCHEMBL18081965 0.73 KDM4E (0.38) KDM4EALDH1A1GLAHSD17B10
SCHEMBL18081790 0.72 KDM4E (0.30) KDM4EALDH1A1KDM4APOLBMAPT
SCHEMBL18081920 0.72 NPC1 (0.32) KDM4EALDH1A1POLBMAPTMEN1
SCHEMBL25462879 0.67 ALDH1A1 (0.40) KDM4EALDH1A1KDM4APOLBMAPT

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 4689/4885ALDH1A1 4189/4885KDM4A 4723/4885

“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.