SCHEMBL8740307

SCHEMBL8740307

CC(C)Oc1ccc(S(N)(=O)=O)cc1Nc1nc(-c2ccc(N3CCCCC3)nc2)cs1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
MAPT P10636 11/20 0.45
MEN1 O00255 11/20 0.45
KMT2A Q03164 11/20 0.45
MAPK1 P28482 4/20 0.45
HTT P42858 3/20 0.45
SMN1; SMN2 Q16637 8/20 0.41
KDM4E B2RXH2 6/20 0.40
ALDH1A1 P00352 5/20 0.40
HPGD P15428 4/20 0.40
LMNA P02545 2/20 0.40
NPSR1 Q6W5P4 1/20 0.39
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ZAP70 P43403 1/20 0.39
CDK1 P06493 1/20 0.38

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
SCHEMBL8521135 0.93 MAPT (0.42) CA1CA2CA9MAPTMEN1
SCHEMBL8533646 0.93 MAPT (0.45) CA1CA2CA9MAPTMEN1
SCHEMBL6118003 0.92 MAPT (0.44) CA1CA2CA9MAPTMEN1
Hydrochloric Acid SCHEMBL6118500 0.92 MAPT (0.44) CA1CA2CA9MAPTMEN1
SCHEMBL8521083 0.92 MAPT (0.44) CA1CA2CA9MAPTMEN1
SCHEMBL8521130 0.92 MAPT (0.44) MAPTMEN1KMT2AMAPK1HTT
SCHEMBL8534195 0.91 MAPT (0.43) CA1CA2CA9MAPTMEN1
SCHEMBL8740284 0.91 MAPT (0.43) CA1CA2CA9MAPTMEN1
SCHEMBL8521132 0.91 MAPT (0.43) CA1CA2CA9MAPTMEN1
SCHEMBL8740282 0.91 MAPT (0.45) CA1CA2CA9MAPTMEN1

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-20120129843-A1 PYRIDYL-THIAZOLYL INHIBITORS OF PRO-MATRIX METALLOPROTEINASE ACTIVATION JANSSEN PHARMACEUTICA N.V. (BE) 2012-05-24 US disclosed
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 CA1 1495/4885CA2 1744/4885CA9 1123/4885

“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.