SCHEMBL6893610

SCHEMBL6893610

CC1Cc2c(ccc(C(=O)O)c2Cl)S1(=O)=O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.32
CASP1 P29466 1/20 0.32
POLB P06746 1/20 0.31
NNMT P40261 1/20 0.31
MAPK1 P28482 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP1A2 P05177 1/20 0.31
PARP1 P09874 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
SCHEMBL6747231 0.82 TSHR (0.33) TSHRSMN1; SMN2CASP1
SCHEMBL6751241 0.81 TSHR (0.33) TSHRSMN1; SMN2ALDH1A1KDM4EMEN1
SCHEMBL6773373 0.80 HPD (0.34)
SCHEMBL6770650 0.79 TDP1 (0.39) POLBALDH1A1KDM4E
SCHEMBL6747230 0.79 KDM4E (0.35) TSHRSMN1; SMN2CASP1ALDH1A1KDM4E
SCHEMBL6753089 0.77 KDM4E (0.32) SMN1; SMN2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL8118574 0.76 ALDH1A1 (0.35) TSHRSMN1; SMN2CASP1POLBMAPK1
Hydrochloric Acid SCHEMBL8118586 0.75 ALDH1A1 (0.34) TSHRSMN1; SMN2CASP1POLBMAPK1
SCHEMBL6747235 0.74
SCHEMBL6749257 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6756343-B1 CONTROLLING RICE PADDY FIELD WEEDS AT LOW DOSAGE DOSE; PLANT SAFENING IDEMITSU KOSAN CO., LTD. (JP) 2004-06-29 US disclosed
US-20040002425-A1 Triketone derivatives and herbicides IDEMITSU KOSAN CO., LTD. (JP) 2004-01-01 US disclosed
EP-1120413-A1 TRIKETONE DERIVATIVE AND HERBICIDE IDEMITSU KOSAN COMPANY LIMITED (JP) 2001-08-01 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-20040002425-A1 Triketone derivatives and herbicides SYMPK, STK36, STK32A TSHR 1166/4885SMN1; SMN2 3530/4885CASP1 638/4885

“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.