SCHEMBL6747301

SCHEMBL6747301

CCOC(=O)c1ccc2c(c1Cl)C(Br)CS2(=O)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CA12 O43570 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 2/20 0.38
METTL3 Q86U44 1/20 0.37
ALDH1A1 P00352 4/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPK1 P28482 2/20 0.34
BAZ2B Q9UIF8 1/20 0.34
BAZ2A Q9UIF9 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
USP2 O75604 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL27595689 0.74 TSHR (0.40) TSHRCYP4F2CYP4A11CA1CA2
SCHEMBL6752025 0.72 POLB (0.45) TSHRCYP4F2CYP4A11CA1CA2
SCHEMBL6751232 0.70 TSHR (0.38) TSHRCYP4F2CYP4A11CA1CA2
SCHEMBL1760338 0.70 TSHR (0.53) TSHRCYP4F2CYP4A11CA1CA2
SCHEMBL6747272 0.69 TSHR (0.42) TSHRCYP4F2CYP4A11CA1CA2
SCHEMBL27993113 0.68 TSHR (0.55) TSHRCYP4F2CYP4A11CA1CA2
SCHEMBL27259744 0.68 CYP4F2 (0.55) TSHRCYP4F2CYP4A11CA1CA2
SCHEMBL7131946 0.68 ALDH1A1 (0.39) TSHRALDH1A1HSD17B10MAPK1LMNA
SCHEMBL6779102 0.68 TSHR (0.41) TSHRCYP4F2CYP4A11CA1CA2
SCHEMBL8136245 0.68 TSHR (0.38) TSHRCA1CA2CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040058957-A1 Benzothiophene derivatives and herbicidal compositions containing the same IDEMITSU KOSAN CO., LTD. (JP) 2004-03-25 US 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-20040058957-A1 Benzothiophene derivatives and herbicidal compositions containing the same DDT, CYP4X1, BPNT1 TSHR 1655/4885CYP4F2 164/4885CYP4A11 788/4885

“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.