SCHEMBL1928210

SCHEMBL1928210

CSC(Oc1cc(C)c(Br)c(C)c1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
LMNA P02545 3/20 0.42
TDP1 Q9NUW8 1/20 0.41
HPGD P15428 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
PPARG P37231 4/20 0.35
PPARA Q07869 4/20 0.35
MAPT P10636 2/20 0.35
STAT3 P40763 1/20 0.35
NOD2 Q9HC29 1/20 0.35
TSHR P16473 4/20 0.34
LDHA P00338 1/20 0.33
TP53 P04637 1/20 0.32
MAPK1 P28482 1/20 0.32
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL1927197 0.86 TDP1 (0.43) ALDH1A1LMNATDP1HPGDSMN1; SMN2
SCHEMBL1928233 0.84 ALDH1A1 (0.46) ALDH1A1LMNATDP1HPGDSMN1; SMN2
SCHEMBL1929200 0.81 LMNA (0.39) ALDH1A1LMNATDP1HPGDSMN1; SMN2
SCHEMBL1927577 0.79 TDP1 (0.38) ALDH1A1TDP1HPGDSMN1; SMN2PPARG
SCHEMBL1928212 0.79 TDP1 (0.66) ALDH1A1LMNATDP1HPGDSMN1; SMN2
SCHEMBL535211 0.76 TDP1 (0.32) TDP1SMN1; SMN2
SCHEMBL1360513 0.75 TPMT (0.38) ALDH1A1PPARGPPARAMAPTTSHR
SCHEMBL4820214 0.75 SMN1; SMN2 (0.69) ALDH1A1LMNATDP1HPGDSMN1; SMN2
SCHEMBL14869156 0.72 CCR1 (0.36) TDP1SMN1; SMN2KDM4E
SCHEMBL10444132 0.72 GAA (0.47) ALDH1A1LMNATDP1HPGDPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7956188-B2 N-substituted-2-alkylthio-2-(substituted aryloxy and heteroaryloxy)alkylamides and their sulphinyl and sulphonyl derivatives such as 2-(3,5-dichlorophenoxy)-2-methylthio-N-2-methylprop-2-yl acetamide; fungal infections of plants SYNGENTA CROP PROTECTION, INC. (US) 2011-06-07 US disclosed
EP-1817309-B1 ACETAMIDE COMPOUNDS AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-12-23 EP disclosed
US-20080171767-A1 N-substituted-2-alkylthio-2-(substituted aryloxy and heteroaryloxy)alkylamides and their sulphinyl and sulphonyl derivatives such as 2-(3,5-dichlorophenoxy)-2-methylthio-N-2-methylprop-2-yl acetamide; fungal infections of plants SYNGENTA CROP PROTECTION, INC. (US) 2008-07-17 US disclosed
EP-1817309-A1 ACETAMIDE COMPOUNDS AS FUNGICIDES Syngeta Participations AG (CH) 2007-08-15 EP disclosed
WO-2006058700-A1 ACETAMIDE COMPOUNDS AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2006-06-08 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-20080171767-A1 N-substituted-2-alkylthio-2-(substituted aryloxy and heteroaryloxy)alkylamides and their sulphinyl and sulphonyl derivatives such as 2-(3,5-dichlorophenoxy)-2-methylthio-N-2-methylprop-2-yl acetamide; fungal infections of plants NAT1, DPM1, AADAC ALDH1A1 895/4885LMNA 4617/4885TDP1 3721/4885

“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.