SCHEMBL1937645

SCHEMBL1937645

CC(=O)c1cccc(Nc2ncc(C(F)(F)F)c(NCC3CC3)n2)c1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 2/20 0.65
PTK2 Q05397 3/20 0.59
FLT3 P36888 9/20 0.56
CHEK1 O14757 1/20 0.54
EGFR P00533 1/20 0.53
BTK Q06187 1/20 0.53
NTRK1 P04629 5/20 0.52

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
SCHEMBL2511202 0.85 KIT (0.62) PTK2FLT3CHEK1EGFRNTRK1
SCHEMBL1937627 0.83 PTK2 (0.64) PRKCQPTK2FLT3CHEK1EGFR
SCHEMBL1937646 0.82 PRKCQ (0.66) PRKCQPTK2FLT3CHEK1EGFR
SCHEMBL1917739 0.79 PRKCQ (1.00) PRKCQFLT3CHEK1
SCHEMBL1916640 0.79 PRKCQ (0.79) PRKCQPTK2FLT3CHEK1
SCHEMBL24486552 0.78 EGFR (0.81) PTK2EGFRBTK
SCHEMBL1916646 0.78 PRKCQ (0.78) PRKCQPTK2FLT3CHEK1
SCHEMBL1917067 0.77 CHEK1 (0.65) PRKCQPTK2FLT3CHEK1
SCHEMBL11916368 0.77 PTK2 (0.62) PTK2FLT3CHEK1EGFRBTK
SCHEMBL3283007 0.77 PTK2 (0.60) PTK2FLT3CHEK1EGFRBTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110245249-A1 Heterocyclically Substituted Anilinopyrimidines BAYER CROPSCIENCE AG (DE) 2011-10-06 US disclosed
EP-2331533-A1 HETEROCYCLICALLY SUBSTITUTED ANILINOPYRIMIDINES AS FUNGICIDES Bayer CropScience AG (DE) 2011-06-15 EP disclosed
WO-2010025850-A1 HETEROCYCLICALLY SUBSTITUTED ANILINOPYRIMIDINES AS FUNGICIDES 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-20110245249-A1 Heterocyclically Substituted Anilinopyrimidines POLL, H1-2, H1-0 PRKCQ 2677/4885PTK2 3644/4885FLT3 612/4885

“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.