SCHEMBL1935153

SCHEMBL1935153

CC(C)CCSc1cccc(Nc2ncc(C(F)(F)F)c(Cl)n2)c1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.43
AR P10275 1/20 0.42
CTSC P53634 8/20 0.41
PRKCQ Q04759 1/20 0.40
CDK1 P06493 5/20 0.39
PTK2 Q05397 2/20 0.38
STK17B O94768 1/20 0.37
STK17A Q9UEE5 1/20 0.37

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
SCHEMBL1935474 0.90 SYK (0.45) SYKCTSCPRKCQCDK1PTK2
SCHEMBL1935118 0.89 SYK (0.46) SYKARCTSCPRKCQCDK1
SCHEMBL1936649 0.87 MET (0.40) SYKCTSCCDK1PTK2
SCHEMBL1935907 0.86 SYK (0.47) SYKCTSCPRKCQCDK1PTK2
SCHEMBL1935627 0.84 SYK (0.47) SYKCTSCPRKCQCDK1PTK2
SCHEMBL2508768 0.82 SYK (0.54) SYKCTSCPRKCQCDK1PTK2
SCHEMBL27839684 0.78 SYK (0.47) SYK
SCHEMBL1938235 0.78 SYK (0.50) SYKCTSCPRKCQCDK1PTK2
SCHEMBL2510831 0.77 SYK (0.46) SYKCTSCPRKCQCDK1PTK2
SCHEMBL2507979 0.76 SYK (0.44) SYKCTSCPRKCQCDK1PTK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110245284-A1 Alkoxy- and Alkylthio-Substituted Anilinopyrimidines BAYER CROPSCIENCE AG (DE) 2011-10-06 US disclosed
CN-102203070-A Alkoxy-and alkylthio-substituted anilinopyrimidines BAYER CROPSCIENCE AG 2011-09-28 CN disclosed
EP-2331512-A1 ALKOXY-SUBSTITUTED AND ALKYLTHIO-SUBSTITUTED ANILINOPYRIMIDINES Bayer CropScience AG (DE) 2011-06-15 EP disclosed
WO-2010025833-A1 ALKOXY-SUBSTITUTED AND ALKYLTHIO-SUBSTITUTED ANILINOPYRIMIDINES BAYER CROPSCIENCE AG (DE) 2010-03-11 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-20110245284-A1 Alkoxy- and Alkylthio-Substituted Anilinopyrimidines HAX1, AGPS, PYM1 SYK 1381/4885AR 2760/4885CTSC 3884/4885

“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.