SCHEMBL1833717

SCHEMBL1833717

COc1ccc(NC(=O)c2cn(Cc3ccc(N)c(C)c3)nc2C(F)(F)C(F)(F)F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 9/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
SNCA P37840 1/20 0.43
LMNA P02545 1/20 0.42
RAF1 P04049 3/20 0.42
KLK1 P06870 1/20 0.42
NPC1 O15118 2/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CCNB2 O95067 1/20 0.41
CCNE2 O96020 1/20 0.41
EGFR P00533 1/20 0.41
CDK1 P06493 1/20 0.41
IGF1R P08069 1/20 0.41
MET P08581 1/20 0.41
SRC P12931 1/20 0.41
CCNB1 P14635 1/20 0.41
BRAF P15056 1/20 0.41

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
SCHEMBL1831746 0.92 KLKB1 (0.48) KLKB1LMNAKLK1MEN1KMT2A
SCHEMBL2161268 0.90 KLKB1 (0.44) KLKB1LMNAKLK1NR1H4
SCHEMBL2161320 0.89 LMNA (0.52) KLKB1LMNAKLK1MEN1KMT2A
SCHEMBL1832795 0.89 PTGDR2 (0.45) KLKB1LMNAKLK1NR1H4
SCHEMBL1833706 0.86 P2RX1 (0.45) KLKB1KLK1KDRNR1H4
SCHEMBL1835631 0.86 KMT2A (0.43) KLKB1L3MBTL1LMNANPC1MEN1
SCHEMBL2161265 0.85 KLKB1 (0.44) KLKB1LMNAKLK1NR1H4
SCHEMBL1837274 0.84 LCK (0.50) LMNAGAASMN1; SMN2MEN1KMT2A
SCHEMBL2161860 0.81 KLKB1 (0.48) KLKB1LMNAKLK1
SCHEMBL1834168 0.80 KLKB1 (0.49) KLKB1KLK1

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-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative BAYER CROPSCIENCE AG (DE) 2011-07-28 US disclosed
EP-2318374-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE Bayer CropScience AG (DE) 2011-05-11 EP disclosed
WO-2010012442-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE BAYER CROPSCIENCE AG (DE) 2010-02-04 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-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative DDT, BRD9, BCL2A1 KLKB1 4858/4885L3MBTL1 217/4885SNCA 2159/4885

“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.