SCHEMBL8740207

SCHEMBL8740207

CC(=O)c1ccc(OC(C)C)c(Nc2nc(-c3ccncc3)cs2)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.49
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
RAB9A P51151 4/20 0.48
NPC1 O15118 3/20 0.48
MAPT P10636 4/20 0.48
POLB P06746 2/20 0.48
ALDH1A1 P00352 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ROCK2 O75116 7/20 0.48
ROCK1 Q13464 7/20 0.48
ALOX5 P09917 2/20 0.47
THRB P10828 1/20 0.44
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
VCP P55072 1/20 0.43

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
SCHEMBL8528620 0.91 CSNK2A1 (0.48) CSNK2A1MEN1KMT2ARAB9ANPC1
Bromide SCHEMBL6118828 0.90 CSNK2A1 (0.48) CSNK2A1MEN1KMT2ARAB9ANPC1
SCHEMBL8740219 0.85 ADORA3 (0.59) CSNK2A1MEN1KMT2AMAPTALDH1A1
SCHEMBL6118024 0.82 NPC1 (0.61) CSNK2A1MEN1KMT2ARAB9ANPC1
SCHEMBL8521768 0.81 MEN1 (0.57) CSNK2A1MEN1KMT2ARAB9ANPC1
SCHEMBL14054860 0.81 CSNK2A1 (0.49) CSNK2A1MEN1KMT2ARAB9ANPC1
Bromide SCHEMBL6117740 0.81 MEN1 (0.56) CSNK2A1MEN1KMT2ARAB9ANPC1
SCHEMBL8738035 0.79 MEN1 (0.45) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL8521250 0.79 CSNK2A1 (0.47) CSNK2A1MEN1KMT2ARAB9ANPC1
SCHEMBL8279323 0.78 MEN1 (0.44) CSNK2A1MEN1KMT2ARAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120129843-A1 PYRIDYL-THIAZOLYL INHIBITORS OF PRO-MATRIX METALLOPROTEINASE ACTIVATION JANSSEN PHARMACEUTICA N.V. (BE) 2012-05-24 US 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-20120129843-A1 PYRIDYL-THIAZOLYL INHIBITORS OF PRO-MATRIX METALLOPROTEINASE ACTIVATION MMP1, MMP9, TIMP3 CSNK2A1 2619/4885MEN1 2671/4885KMT2A 3083/4885

“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.