SCHEMBL2507979

SCHEMBL2507979

CCSC(C)c1cccc(Nc2ncc(C(F)(F)F)c(Cl)n2)c1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.44
PRKCQ Q04759 1/20 0.43
CDK1 P06493 5/20 0.42
CTSC P53634 5/20 0.40
PTK2 Q05397 2/20 0.39
AURKA O14965 2/20 0.38
CNR2 P34972 1/20 0.38
STK17A Q9UEE5 2/20 0.38
STK17B O94768 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
SCHEMBL2510831 0.88 SYK (0.46) SYKPRKCQCDK1CTSCPTK2
SCHEMBL1938235 0.86 SYK (0.50) SYKPRKCQCDK1CTSCPTK2
SCHEMBL1933968 0.84 SYK (0.51) SYKPRKCQCDK1CTSCPTK2
SCHEMBL2511679 0.82 SYK (0.46) SYKPRKCQCDK1CTSCPTK2
SCHEMBL1935907 0.81 SYK (0.47) SYKPRKCQCDK1CTSCPTK2
SCHEMBL1917536 0.79 CDK1 (0.59) SYKPRKCQCDK1CTSCCNR2
SCHEMBL1935627 0.78 SYK (0.47) SYKPRKCQCDK1CTSCPTK2
SCHEMBL1935474 0.78 SYK (0.45) SYKPRKCQCDK1CTSCPTK2
SCHEMBL2508768 0.77 SYK (0.54) SYKPRKCQCDK1CTSCPTK2
SCHEMBL1935118 0.77 SYK (0.46) SYKPRKCQCDK1CTSCPTK2

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-20110245284-A1 Alkoxy- and Alkylthio-Substituted Anilinopyrimidines BAYER CROPSCIENCE AG (DE) 2011-10-06 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-20110245284-A1 Alkoxy- and Alkylthio-Substituted Anilinopyrimidines HAX1, AGPS, PYM1 SYK 1381/4885PRKCQ 3691/4885CDK1 1738/4885

“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.