SCHEMBL271289

SCHEMBL271289

O=S(=O)(Cl)Cc1cc(I)ccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.37
ALDH1A1 P00352 4/20 0.34
KDM4E B2RXH2 3/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KMT2A Q03164 2/20 0.31
MAPK1 P28482 1/20 0.31
TSHR P16473 1/20 0.30
AKR1B1 P15121 1/20 0.30
RAD51 Q06609 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
SCHEMBL271296 0.85 IDO1 (0.49) IDO1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL2935285 0.83 IDO1 (0.36) IDO1ALDH1A1KDM4EMAPTHPGD
SCHEMBL270092 0.83 RAD51 (0.36) IDO1ALDH1A1KDM4EMAPTHPGD
SCHEMBL3386780 0.80 TP53 (0.41) IDO1ALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL28107699 0.77 IDO1 (0.42) IDO1SMN1; SMN2MAPK1TSHR
SCHEMBL16046605 0.77 PSEN1 (0.47) ALDH1A1KDM4EMAPTHPGDKMT2A
SCHEMBL8225128 0.75 IDO1 (0.41) IDO1ALDH1A1KDM4EKMT2A
SCHEMBL5963 0.75 ALDH1A1 (0.55) IDO1ALDH1A1KDM4EMAPTHPGD
SCHEMBL16235067 0.73 S100A9 (0.51) MAPTRAD51
SCHEMBL270420 0.73 ALDH1A1 (0.44) ALDH1A1KDM4EMAPTKMT2ATSHR

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
EP-2220056-B1 HERBICIDAL COMPOUNDS SYNGENTA LTD (GB) 2015-09-30 EP disclosed
US-8133849-B2 Herbicidal compounds SYNGENTA LIMITED (GB) 2012-03-13 US disclosed
US-20100323889-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-12-23 US disclosed
EP-2220056-A1 HERBICIDAL COMPOUNDS Syngenta Limited (GB) 2010-08-25 EP disclosed
WO-2009063180-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2009-05-22 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-20100323889-A1 HERBICIDAL COMPOUNDS CBR3, DDT, CBR1 IDO1 590/4885ALDH1A1 127/4885KDM4E 2179/4885

“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.