SCHEMBL5269769

SCHEMBL5269769

CCCCCc1ccc(OS(=O)(=O)Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.53
THRB P10828 3/20 0.50
CA1 P00915 1/20 0.49
CA9 Q16790 1/20 0.49
STS P08842 4/20 0.48
THRA P10827 2/20 0.48
FUT7 Q11130 1/20 0.46
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ESR1 P03372 2/20 0.46
ADRA2A P08913 2/20 0.46
ADORA3 P0DMS8 2/20 0.46
TACR2 P21452 2/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
LMNA P02545 2/20 0.46
CYP3A4 P08684 2/20 0.46
KDM4E B2RXH2 1/20 0.46
SHBG P04278 1/20 0.46

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
SCHEMBL5427923 0.98 CA2 (0.51) CA2THRBCA1CA9STS
SCHEMBL5428903 0.95 CA2 (0.51) CA2THRBCA1CA9STS
SCHEMBL5265636 0.86 CA2 (0.56) CA2THRBCA1CA9STS
SCHEMBL10181185 0.84 CA2 (0.54) CA2THRBCA1CA9STS
SCHEMBL10181464 0.84 CA2 (0.54) CA2THRBCA1CA9STS
SCHEMBL3374603 0.84 CA2 (0.54) CA2THRBCA1CA9STS
SCHEMBL5269778 0.83 CA2 (0.50) CA2THRBCA1CA9STS
SCHEMBL2134736 0.83 CA2 (0.53) CA2THRBCA1CA9STS
SCHEMBL3950036 0.83 THRB (0.54) CA2THRBCA1CA9STS
SCHEMBL5616239 0.82 CA2 (0.49) CA2THRBCA1CA9STS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070020384-A1 Environmentally benign crop protection agents CUTLER, ELIOT 2007-01-25 US disclosed
US-7108861-B1 Environmentally benign crop protection agents CERNOFINA, LLC (US) 2006-09-19 US disclosed
EP-1115285-A1 SAFE AND EFFECTIVE BIOFILM INHIBITORY COMPOUNDS AND HEALTH-RELATED USES THEREOF Phycogen, Inc. (US) 2001-07-18 EP disclosed
EP-1115289-A2 ENVIRONMENTALLY BENIGN CROP PROTECTION AGENTS Phycogen, Inc. (US) 2001-07-18 EP disclosed
WO-2000016624-A1 SAFE AND EFFECTIVE BIOFILM INHIBITORY COMPOUNDS AND HEALTH-RELATED USES THEREOF PHYCOGEN, INC. (US) 2000-03-30 WO disclosed
WO-2000016632-A2 ENVIRONMENTALLY BENIGN CROP PROTECTION AGENTS PHYCOGEN, INC. (US) 2000-03-30 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-20070020384-A1 Environmentally benign crop protection agents CTSA, CNDP2, DDT CA2 1174/4885THRB 3018/4885CA1 1599/4885

“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.