SCHEMBL6779102

SCHEMBL6779102

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 2/20 0.38
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
HSD17B10 Q99714 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 2/20 0.35
METTL3 Q86U44 1/20 0.35
BAZ2B Q9UIF8 1/20 0.35
BAZ2A Q9UIF9 1/20 0.35
CDC25B P30305 1/20 0.35
MAPT P10636 3/20 0.34
GAA P10253 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 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 0.86 TSHR (0.40) TSHRCA12CA1CA2CA7
SCHEMBL27578173 0.73 LMNA (0.43) TSHRCA12CA1CA2CA7
SCHEMBL6773254 0.72 TSHR (0.41) TSHRCA12CA1CA2CA7
SCHEMBL27993113 0.69 TSHR (0.55) TSHRCA12CA1CA2CA7
SCHEMBL27259744 0.69 CYP4F2 (0.55) TSHRCA12CA1CA2CA7
SCHEMBL6747301 0.68 TSHR (0.40) TSHRCA12CA1CA2CA7
SCHEMBL1760338 0.67 TSHR (0.53) TSHRCA12CA1CA2CA7
SCHEMBL8404136 0.67 GAA (0.36) TSHRCA1CA2CYP4F2CYP4A11
SCHEMBL3436904 0.66 CYP4F2 (0.53) TSHRCA12CA1CA2CA7
SCHEMBL31380439 0.66 CYP4F2 (0.53) TSHRCA12CA1CA2CA7

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-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
CN-1350531-A azole compounds and herbicidal compositions IDEMITSU KOSAN CO (JP) 2002-05-22 CN disclosed
EP-1182203-A1 AZOLE COMPOUNDS AND HERBICIDE COMPOSITIONS Idemitsu Kosan Co., Ltd. (JP) 2002-02-27 EP 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 1166/4885CA12 2947/4885CA1 2942/4885

“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.