SCHEMBL4074200

SCHEMBL4074200

CS(=O)(=O)OCc1ccc(C(=O)c2ccc(F)c(F)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
VNN1 O95497 4/20 0.44
ACHE P22303 3/20 0.44
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
PTGS2 P35354 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ATM Q13315 1/20 0.37
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL507931 0.78 KMT2A (0.50) ALDH1A1HTTSMN1; SMN2L3MBTL1ATM
SCHEMBL7810345 0.75 PTGS2 (0.60) CES2CES1PTGS2
SCHEMBL1002846 0.75 CES2 (0.53) MAOAMAOBVNN1ACHECES2
SCHEMBL22158837 0.75 KMT2A (0.53) MAOAMAOBALDH1A1HTTSMN1; SMN2
SCHEMBL27786436 0.75 KMT2A (0.54) ALDH1A1SMN1; SMN2RAB9A
SCHEMBL7967901 0.74 CES2 (0.73) VNN1CES2CES1RAB9A
SCHEMBL4952656 0.74 CA2 (0.58) PTGS2ALDH1A1HTTSMN1; SMN2RAB9A
SCHEMBL2883300 0.74 CES2 (0.44) MAOAMAOBVNN1ACHECES2
SCHEMBL780272 0.72 CA2 (0.48) MAOB
SCHEMBL507343 0.72 KMT2A (0.48) VNN1ALDH1A1HTTSMN1; SMN2L3MBTL1

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-20090247560-A1 Diaryl ketimine derivative BANYU PHARMACEUTICAL CO., LTD. 2009-10-01 US disclosed
EP-2072519-A1 DIARYL KETIMINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-06-24 EP 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-20090247560-A1 Diaryl ketimine derivative NR0B2, NR2C2, NR3C2 MAOA 577/4885MAOB 225/4885VNN1 4382/4885

“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.