SCHEMBL5517420

SCHEMBL5517420

O=C(NC(F)F)c1ccccc1B(O)O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
PADI4 Q9UM07 1/20 0.39
GAA P10253 1/20 0.38
CLPP Q16740 2/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL5983378 0.90 MEN1 (0.36) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL5982667 0.82 MEN1 (0.36) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL20548792 0.78 MEN1 (0.44) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL791333 0.77 GAA (0.57) KDM4EGAAPOLB
SCHEMBL29469069 0.77 GAA (0.57) KDM4EGAAPOLB
SCHEMBL31255732 0.76 GAA (0.37) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL31255734 0.76 GAA (0.37) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL3784749 0.73 HPGD (0.62) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL4763194 0.73 PTGS2 (0.43) KMT2AALDH1A1KDM4ELMNAHSD17B10
SCHEMBL28063627 0.72 ENPP2 (0.40) MEN1KMT2AALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070082877-A1 Difluoromethylbenzanilides and use thereof for combating micro-organisms, intermediate products and use thereof BAYER CORPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-04-12 US claimed
US-20070082877-A1 Difluoromethylbenzanilides and use thereof for combating micro-organisms, intermediate products and use thereof BAYER CORPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-04-12 US 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-20070082877-A1 Difluoromethylbenzanilides and use thereof for combating micro-organisms, intermediate products and use thereof FBL, Q6ZSR9, DDT MEN1 772/4885KMT2A 1279/4885ALDH1A1 380/4885

“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.