SCHEMBL1830252

SCHEMBL1830252

Cc1cc(Cc2nc(C(F)(F)C(F)(F)F)cc(C(F)(F)C(F)(F)F)n2)ccc1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.40
S100B P04271 1/20 0.34
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 2/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MPO P05164 1/20 0.32
ESR1 P03372 3/20 0.31
ESR2 Q92731 2/20 0.31
AR P10275 1/20 0.31
KDM4E B2RXH2 2/20 0.31
MAPT P10636 2/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
RAD52 P43351 1/20 0.31

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
SCHEMBL2161183 0.96 SKP2 (0.37) SKP2S100BALDH1A1CYP3A4TSHR
SCHEMBL1826287 0.88 SKP2 (0.41) SKP2S100BALDH1A1CYP3A4TSHR
SCHEMBL1828505 0.88 SKP2 (0.35) SKP2S100BKDM4EMEN1KMT2A
SCHEMBL1832734 0.80 TSHR (0.43) SKP2S100BALDH1A1CYP3A4TSHR
SCHEMBL2892310 0.79 SKP2 (0.36) SKP2S100BALDH1A1CYP3A4TSHR
SCHEMBL2170567 0.79 SKP2 (0.36) SKP2S100BTSHRTDP1MAPT
SCHEMBL1828519 0.78 MAPT (0.38) ALDH1A1CYP3A4TSHRARMAPT
SCHEMBL1829075 0.76 SKP2 (0.34) SKP2ALDH1A1KDM4EMAPTMEN1
SCHEMBL1831014 0.75 SKP2 (0.33) SKP2
SCHEMBL1829024 0.75 MAPT (0.35) ALDH1A1CYP3A4TSHRARMAPT

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 SKP2 2201/4885S100B 3450/4885ALDH1A1 928/4885

“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.