SCHEMBL1832553

SCHEMBL1832553

CSc1cccc2c1C(=O)N(c1ccc(Cn3nc(C(F)(F)F)cc3C(F)(F)F)cc1C)C2=O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 1/20 0.40
USP1 O94782 1/20 0.35
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GRM1 Q13255 7/20 0.33
GRM4 Q14833 6/20 0.33
HDAC3 O15379 2/20 0.31
HDAC4 P56524 2/20 0.31
HDAC1 Q13547 2/20 0.31
HDAC7 Q8WUI4 2/20 0.31
HDAC2 Q92769 2/20 0.31
HDAC10 Q969S8 2/20 0.31
HDAC11 Q96DB2 2/20 0.31
HDAC8 Q9BY41 2/20 0.31
HDAC6 Q9UBN7 2/20 0.31
HDAC9 Q9UKV0 2/20 0.31
HDAC5 Q9UQL6 2/20 0.31
NCOR2 Q9Y618 2/20 0.31
TYMS P04818 1/20 0.30

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
SCHEMBL12402290 0.92 HPGD (0.35) USP1LMNASMN1; SMN2GRM1GRM4
SCHEMBL1835455 0.88 GRM1 (0.42) GRIA2GRM1GRM4
SCHEMBL2161154 0.87 GRIA2 (0.39) GRIA2LMNASMN1; SMN2GRM1GRM4
SCHEMBL1846700 0.87 GRM1 (0.42) GRIA2LMNASMN1; SMN2GRM1GRM4
SCHEMBL1835277 0.87 GRIA2 (0.39) GRIA2LMNASMN1; SMN2GRM1GRM4
SCHEMBL1848131 0.87 GRIA2 (0.43) GRIA2GRM1GRM4HDAC3HDAC4
SCHEMBL2891892 0.83 GRIA2 (0.39) GRIA2LMNASMN1; SMN2GRM1GRM4
SCHEMBL12402289 0.80 GRM1 (0.43) GRM1GRM4
SCHEMBL12402282 0.79 GRM1 (0.43) LMNASMN1; SMN2GRM1GRM4
SCHEMBL12402159 0.78 POLB (0.43) USP1LMNAGRM1GRM4HDAC3

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 GRIA2 3485/4885USP1 1205/4885LMNA 1928/4885

“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.