SCHEMBL6828511

SCHEMBL6828511

CCN(c1ccc(C#N)cc1)S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 1/20 0.73
RORC P51449 5/20 0.64
ESR1 P03372 1/20 0.56
KDM1A O60341 11/20 0.56
CNR1 P21554 1/20 0.55
CNR2 P34972 1/20 0.55
KEAP1 Q14145 1/20 0.52
NFE2L2 Q16236 1/20 0.52

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
SCHEMBL8657231 0.82 RORC (0.53) HCRTR2RORCESR1KDM1A
SCHEMBL6297504 0.80 ESR1 (0.87) HCRTR2ESR1CNR1CNR2KEAP1
SCHEMBL6553128 0.80 HCRTR2 (0.53) HCRTR2RORCKDM1ACNR1CNR2
SCHEMBL5604160 0.80 ESR1 (0.73) ESR1CNR1CNR2KEAP1NFE2L2
SCHEMBL28133849 0.80 CNR1 (0.69) HCRTR2RORCESR1CNR1CNR2
SCHEMBL28897960 0.79 KDM4E (0.55) HCRTR2RORCKDM1A
SCHEMBL6828361 0.79 PSEN1 (0.52) HCRTR2RORCKDM1ACNR1CNR2
SCHEMBL6157398 0.77 ALDH1A1 (0.58) HCRTR2RORCESR1KDM1A
SCHEMBL3636387 0.76 LMNA (0.63) HCRTR2KDM1A
SCHEMBL28383987 0.75 HCRTR2 (0.46) HCRTR2RORCESR1KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040023938-A1 Sulfonamide derivatives TABUCHI TAKANORI (JP) 2004-02-05 US disclosed
US-6586617-B1 Nontoxic microbiocides such as 4'-chloro-N-ethyl-2'-nitro-p-toluenesulfonanilide, for agricultural or horticultural, prepared by alkylation or nitration SUMITOMO CHEMICAL TAKEDA AGRO COMPANY, LIMITED (JP) 2003-07-01 US disclosed
EP-1174028-A1 SULFONAMIDE DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2002-01-23 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-20040023938-A1 Sulfonamide derivatives FPR1, MRM1, SULT1E1 HCRTR2 411/4885RORC 1611/4885ESR1 1772/4885

“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.