SCHEMBL2940693

SCHEMBL2940693

O=C(Nc1ccccc1I)c1ccccc1C(F)(F)F

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.61
LMNA P02545 1/20 0.60
GAA P10253 1/20 0.60
RXFP1 Q9HBX9 3/20 0.59
KCNK3 O14649 2/20 0.54
KCNK9 Q9NPC2 2/20 0.54
PTGS1 P23219 1/20 0.54
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
PTPRC P08575 1/20 0.50
RECQL P46063 1/20 0.49
KDM4E B2RXH2 1/20 0.49
POLB P06746 1/20 0.48
EPHB3 P54753 1/20 0.48
F2R P25116 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL27582898 0.84 LMNA (0.67) SMN1; SMN2LMNAGAARXFP1KCNK3
SCHEMBL13477980 0.83 SMN1; SMN2 (0.60) SMN1; SMN2LMNAGAARXFP1KCNK3
SCHEMBL21311188 0.83 HTT (0.62) SMN1; SMN2LMNAGAARXFP1KCNK3
SCHEMBL12918684 0.83 SMN1; SMN2 (0.64) SMN1; SMN2LMNAGAARXFP1KCNK3
SCHEMBL2936256 0.83 SMN1; SMN2 (0.78) SMN1; SMN2LMNAGAARXFP1KCNK3
SCHEMBL26066184 0.80 SMN1; SMN2 (0.57) SMN1; SMN2LMNAGAARXFP1KCNK3
SCHEMBL16371758 0.80 LMNA (0.55) SMN1; SMN2LMNAGAARXFP1KCNK3
SCHEMBL21311187 0.79 SMN1; SMN2 (0.56) SMN1; SMN2LMNAGAARXFP1KCNK3
SCHEMBL15925029 0.79 RXFP1 (0.57) SMN1; SMN2LMNAGAARXFP1KCNK3
SCHEMBL2937452 0.79 SMN1; SMN2 (0.56) SMN1; SMN2LMNAGAARXFP1KCNK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480516-B1 MICROBICIDAL AGENTS ON THE BASIS OF BIPHENYL BENZAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2010-02-03 EP disclosed
EP-1480516-B1 MICROBICIDAL AGENTS ON THE BASIS OF BIPHENYL BENZAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2010-02-03 EP disclosed
US-7186862-B2 Microbicidal agents on the basis of biphenylbenzamide derivatives BAYER CROPSCIENCE AG (DE) 2007-03-06 US disclosed
US-7186862-B2 Microbicidal agents on the basis of biphenylbenzamide derivatives BAYER CROPSCIENCE AG (DE) 2007-03-06 US disclosed
US-7186862-B2 Microbicidal agents on the basis of biphenylbenzamide derivatives BAYER CROPSCIENCE AG (DE) 2007-03-06 US disclosed
CN-1845673-A Pyridylacanilides BAYER CROPSCIENCE AG (DE) 2006-10-11 CN disclosed
EP-1656020-A2 PYRIDINYLANILIDES Bayer CropScience AG (DE) 2006-05-17 EP disclosed
US-20050119347-A1 Microbicidal agents on the basis of biphenyl benzamide derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2005-06-02 US disclosed
WO-2005004606-A2 PYRIDINYLANILIDES BAYER CROPSCIENCE AG (DE) 2005-01-20 WO disclosed
EP-1480516-A1 MICROBICIDAL AGENTS ON THE BASIS OF BIPHENYL BENZAMIDE DERIVATIVES Bayer CropScience AG (DE) 2004-12-01 EP disclosed
WO-2003069995-A1 MICROBICIDAL AGENTS ON THE BASIS OF BIPHENYL BENZAMIDE DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-08-28 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-20050119347-A1 Microbicidal agents on the basis of biphenyl benzamide derivatives DDT, MSR1, CYP1B1 SMN1; SMN2 3753/4885LMNA 4173/4885GAA 1471/4885

“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.