SCHEMBL6772652

SCHEMBL6772652

O=C(O)c1ccc2c(c1Br)CCS2(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
VEGFA P15692 1/20 0.41
CYP1A2 P05177 1/20 0.33
CTSL P07711 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
TSHR P16473 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
SCHEMBL6752193 0.81 TSHR (0.39) VEGFACYP1A2CA1CA2CA9
SCHEMBL6895329 0.80 HAAO (0.35) CYP1A2TSHR
SCHEMBL6773040 0.78 MCL1 (0.33) CYP1A2
SCHEMBL6772585 0.76 TDP1 (0.41) VEGFACYP1A2
SCHEMBL6771292 0.76 VEGFA (0.44) VEGFACYP1A2
SCHEMBL17671171 0.74 VEGFA (0.53) VEGFACTSLCA1CA2CA9
SCHEMBL2818703 0.73 KMT2A (0.34) VEGFACA1CA2CA9
SCHEMBL7510686 0.72 LMNA (0.39) CYP1A2TSHR
SCHEMBL14972333 0.71 VEGFA (0.36) VEGFACA1CA2CA9
SCHEMBL1372033 0.69 CYP1A2 (0.58) CYP1A2CA1CA2CA9TSHR

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 VEGFA 3895/4885CYP1A2 980/4885CTSL 3056/4885

“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.