SCHEMBL6916253

SCHEMBL6916253

CNC(=O)[C@@H](C(=O)NCCc1ccc(-c2cc(N)ccc2S(=O)(=O)O)cc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA12 O43570 2/20 0.44
CA4 P22748 2/20 0.44
CA9 Q16790 2/20 0.44
POLB P06746 2/20 0.39
GLI1 P08151 1/20 0.37
GLI2 P10070 1/20 0.37
OPRK1 P41145 1/20 0.37
HIF1A Q16665 1/20 0.37
MMP3 P08254 1/20 0.37
HDAC1 Q13547 1/20 0.36
ESRRG P62508 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
ALOX15 P16050 1/20 0.36
GNG2 P59768 1/20 0.36

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
SCHEMBL6803118 0.76 POLB (0.48) CA1CA2CA12CA4CA9
SCHEMBL6803123 0.76 POLB (0.48) CA1CA2CA12CA4CA9
SCHEMBL2272811 0.70 ALDH1A1 (0.51) POLBMEN1KMT2ACYP1A2CYP2C9
SCHEMBL6916260 0.70 CNR2 (0.45) KMT2AKDM4EALDH1A1MAPT
SCHEMBL19470796 0.69 RAPGEF4 (0.46) CA1CA2CA12CA9POLB
SCHEMBL19470800 0.67 RAPGEF4 (0.49) CA1CA2CA12CA9POLB
SCHEMBL17519900 0.67 GLI1 (0.59) CA1CA2CA12CA4CA9
SCHEMBL6923899 0.67 CNR1 (0.69) POLBMEN1KMT2AALDH1A1
SCHEMBL14861138 0.67 POLB (0.61) CA2CA12CA9POLBOPRK1
SCHEMBL17204643 0.66 NAAA (0.54) POLBGLI1GLI2HIF1AESRRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040167183-A1 Phenethylamino sulfamic acids THE PROCTER & GAMBLE COMPANY 2004-08-26 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 (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 CA1 2299/4885CA2 1472/4885CA12 2951/4885

“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.