SCHEMBL10246323

SCHEMBL10246323

CC(C)(C)Cc1csc(Cl)n1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 1/20 0.42
SLC6A3 Q01959 1/20 0.38
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
GFER P55789 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL1912692 0.77 GAA (0.44) CCR4SLC6A3ALDH1A1TDP1
SCHEMBL21325318 0.77 CCR4 (0.43) CCR4SLC6A3CNR1CNR2ALDH1A1
SCHEMBL1990600 0.76
SCHEMBL12926881 0.75 HRH1 (0.44) CCR4CNR1CNR2
SCHEMBL15470626 0.75 HSD17B10 (0.48) CCR4GFERALDH1A1
SCHEMBL24822461 0.73 SLC6A3 (0.42) CCR4SLC6A3CNR1CNR2
SCHEMBL18014780 0.73 GFER (0.45) CCR4CNR1CNR2GFERALDH1A1
SCHEMBL13021103 0.73 GFER (0.66) CNR1CNR2GFERALDH1A1TDP1
SCHEMBL5884292 0.73 SLC6A3 (0.35) SLC6A3TDP1L3MBTL1
SCHEMBL937324 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9314025-B2 Mixtures of mesoionic pesticides E I DU PONT DE NEMOURS AND COMPANY (US) 2016-04-19 US disclosed
US-20140187776-A1 MIXTURES OF MESOIONIC PESTICIDES E I DU PONT DE NEMOURS AND COMPANY (US) 2014-07-03 US disclosed
US-20120115722-A1 MIXTURES OF MESOIONIC PESTICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-05-10 US disclosed
US-20120115722-A1 MIXTURES OF MESOIONIC PESTICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-05-10 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 (2 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-20140187776-A1 MIXTURES OF MESOIONIC PESTICIDES DDT, C5, CBR3 CCR4 26/4885SLC6A3 331/4885CNR1 91/4885
US-20120115722-A1 MIXTURES OF MESOIONIC PESTICIDES DDT, C5, CBR3 CCR4 26/4885SLC6A3 331/4885CNR1 91/4885

“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.