SCHEMBL6803763

SCHEMBL6803763

Cc1ccc(S(=O)(=O)N(CCc2ccc(NS(=O)(=O)O)cc2)CCC(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.48
BACE1 P56817 1/20 0.44
ALDH1A1 P00352 2/20 0.44
RORC P51449 2/20 0.43
BMP1 P13497 4/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA9 Q16790 1/20 0.43
TP53 P04637 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL6808058 0.83 ALDH1A1 (0.53) CNR2ALDH1A1BMP1CA12CA1
SCHEMBL6802936 0.82 CNR2 (0.53) CNR2BACE1RORCBMP1CA12
SCHEMBL6802688 0.82 CNR2 (0.75) CNR2CA12CA1CA2CA4
SCHEMBL6801277 0.81 CNR2 (0.47) CNR2BACE1ALDH1A1BMP1CA12
SCHEMBL6803413 0.81 CNR2 (0.49) CNR2BACE1ALDH1A1RORCBMP1
SCHEMBL6798304 0.79 THRB (0.51) CNR2ALDH1A1BMP1CA12CA1
SCHEMBL6800802 0.76 ALDH1A1 (0.47) CNR2ALDH1A1TP53MEN1KMT2A
SCHEMBL6803488 0.73 LIMK2 (0.49) CNR2ALDH1A1BMP1CA12CA1
SCHEMBL6796826 0.73 PTPRB (0.45) CNR2ALDH1A1TP53MEN1KMT2A
SCHEMBL3512547 0.69 CNR2 (0.48) CNR2BACE1ALDH1A1RORCMEN1

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-20040167183-A1 Phenethylamino sulfamic acids THE PROCTER & GAMBLE COMPANY 2004-08-26 US claimed
WO-2004074238-A1 PHENETHYLAMINO SULFAMIC ACIDS THE PROCTER & GAMBLE COMPANY (US) 2004-09-02 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-20040167183-A1 Phenethylamino sulfamic acids PTPRM, PTPRS, PTPRE CNR2 4684/4885BACE1 4410/4885ALDH1A1 622/4885

“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.