SCHEMBL6802957

SCHEMBL6802957

CC1(N=C(N)NS(=O)(=O)c2sc(Cl)cc2Br)CC1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 1/20 0.38
CCKBR P32239 1/20 0.38
SLC9A1 P19634 1/20 0.31
ABCC8 Q09428 1/20 0.30
KCNJ11 Q14654 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
SCHEMBL7563531 0.88 MCL1 (0.36) ABCC8KCNJ11
SCHEMBL6807253 0.79 CCR4 (0.40) CCR4CCKBRSLC9A1
SCHEMBL6798130 0.78
SCHEMBL6847201 0.77 CCR4 (0.43) CCR4CCKBR
SCHEMBL6801536 0.76 PSEN1 (0.42)
SCHEMBL6804322 0.74 CCR4 (0.41) CCR4CCKBR
SCHEMBL6802953 0.74 CCR4 (0.38) CCR4CCKBR
SCHEMBL7567612 0.71 CCR4 (0.42) CCR4CCKBR
SCHEMBL7562585 0.70 CCR4 (0.48) CCR4CCKBR
SCHEMBL6807252 0.67 CCR4 (0.40) CCR4CCKBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040010142-A1 Novel process NOVO NORDISK A/S (DK) 2004-01-15 US disclosed
US-20020119969-A1 Novel process NOVO NORDISK A/S (DK) 2002-08-29 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-20040010142-A1 Novel process UGT1A1, CYP4X1, CYP4B1 CCR4 2292/4885CCKBR 977/4885SLC9A1 1176/4885
US-20020119969-A1 Novel process CYP3A5, CYP4F2, CYP4F12 CCR4 3947/4885CCKBR 1602/4885SLC9A1 3994/4885

“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.