SCHEMBL12733115

SCHEMBL12733115

COC(=O)c1csc(C)c1C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
CHEK1 O14757 1/20 0.40
MET P08581 1/20 0.40
GSK3B P49841 1/20 0.40
LIMK1 P53667 1/20 0.40
DYRK1A Q13627 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
DYRK1B Q9Y463 1/20 0.40
RAF1 P04049 2/20 0.38
LMNA P02545 2/20 0.37
POLB P06746 2/20 0.37
KDM4E B2RXH2 2/20 0.36
EED O75530 1/20 0.36
RBBP4 Q09028 1/20 0.36
SUZ12 Q15022 1/20 0.36
EZH2 Q15910 1/20 0.36
AEBP2 Q6ZN18 1/20 0.36
CYP46A1 Q9Y6A2 1/20 0.36
TSHR P16473 1/20 0.35
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL7211424 0.77 MAPT (0.47) MAPTCHEK1METGSK3BLIMK1
SCHEMBL9375759 0.76 MAPT (0.46) MAPTCHEK1METGSK3BLIMK1
SCHEMBL8243303 0.74 MAPT (0.45) MAPTCHEK1METGSK3BLIMK1
SCHEMBL1617947 0.74 MAPT (0.45) MAPTCHEK1METGSK3BLIMK1
Hydrochloric Acid SCHEMBL1617128 0.73 MAPT (0.44) MAPTCHEK1METGSK3BLIMK1
SCHEMBL30461811 0.73 MAPT (0.44) MAPTCHEK1METGSK3BLIMK1
SCHEMBL12806874 0.71 HPGD (0.54) MAPTLMNAKDM4EALDH1A1MEN1
SCHEMBL167135 0.71 RAF1 (0.45) MAPTRAF1MAPK14
SCHEMBL17241129 0.71 ATR (0.51) MAPTCHEK1METGSK3BLIMK1
SCHEMBL9371767 0.70 MAPT (0.45) MAPTCHEK1METGSK3BLIMK1

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-7932283-B2 Fungicide N-cyclopropyl-sulfonylamide derivatives BAYER CROPSCIENCE AG (DE) 2011-04-26 US disclosed
US-20090137611-A1 Fungicide N-Cyclopropyl-Sulfonylamide Derivatives BAYER CROPSCIENCE AG (DE) 2009-05-28 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-20090137611-A1 Fungicide N-Cyclopropyl-Sulfonylamide Derivatives CYP51A1, ERG28, CBR3 MAPT 2939/4885CHEK1 4369/4885MET 3773/4885

“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.