SCHEMBL1637412

SCHEMBL1637412

CCn1ncc(C(=O)c2ccc(C(F)(F)F)c(S(=O)(=O)CC)c2C)c1O

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
RAB9A P51151 2/20 0.34
ALDH1A1 P00352 2/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
NR3C1 P04150 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL10053360 0.91 LMNA (0.34) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL12724669 0.84 LMNA (0.36) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL1634766 0.80 RAB9A (0.36) LMNASMN1; SMN2RAB9AALDH1A1NR3C1
SCHEMBL1236175 0.80 RAF1 (0.31) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL10053357 0.80 SMN1; SMN2 (0.33) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL12724679 0.77 LMNA (0.36) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL10872717 0.77 LMNA (0.38) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL10053361 0.76 AR (0.32) ALDH1A1
SCHEMBL23940126 0.74 RAB9A (0.31) LMNASMN1; SMN2RAB9AALDH1A1NR3C1
SCHEMBL8183276 0.74 LMNA (0.36) LMNASMN1; SMN2RAB9AALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932211-B2 4-(4-trifluoromethyl-3-thiobenzoyl)pyrazoles and their use as herbicides BAYER CROPSCIENCE AG (DE) 2011-04-26 US disclosed
EP-2137160-B1 4-(4-TRIFLUOROMETHYL-3-THIOBENZOYL)PYRAZOLES AND USE THEREOF AS HERBICIDES BAYER CROPSCIENCE AG (DE) 2010-10-27 EP disclosed
EP-2137160-A1 4-(4-TRIFLUOROMETHYL-3-THIOBENZOYL)PYRAZOLES, AND USE THEREOF AS HERBICIDES Bayer CropScience AG (DE) 2009-12-30 EP disclosed
US-20090069184-A1 4-(4-trifluoromethyl-3-thiobenzoyl)pyrazoles and their use as herbicides BAYER CROPSCIENCE AG (DE) 2009-03-12 US disclosed
WO-2008125214-A1 4-(4-TRIFLUOROMETHYL-3-THIOBENZOYL)PYRAZOLES, AND USE THEREOF AS HERBICIDES BAYER CROPSCIENCE AG (DE) 2008-10-23 WO disclosed
EP-1980556-A1 4-(4-trifluor methyl-3-thiobenzoyl) pyrazoles and their application as herbicides Bayer CropScience AG (DE) 2008-10-15 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-20090069184-A1 4-(4-trifluoromethyl-3-thiobenzoyl)pyrazoles and their use as herbicides TH, DDT, CYP4X1 LMNA 4746/4885SMN1; SMN2 4667/4885RAB9A 2045/4885

“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.