SCHEMBL2995708

SCHEMBL2995708

COc1ccc(NC(=O)[C@H](C)N(C)C(=O)O)cc1NS(=O)(=O)c1ccc(-c2ccccc2F)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
KMT2A Q03164 4/20 0.46
KDM4E B2RXH2 3/20 0.46
LMNA P02545 3/20 0.46
MAPT P10636 3/20 0.46
HPGD P15428 2/20 0.46
ACLY P53396 8/20 0.45
GRM4 Q14833 1/20 0.42
MEN1 O00255 3/20 0.41
HTT P42858 1/20 0.40
FABP4 P15090 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
GHSR Q92847 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
SCHEMBL2995707 0.85 ALDH1A1 (0.46) ALDH1A1KMT2AKDM4ELMNAMAPT
SCHEMBL2988757 0.83 IDH1 (0.43) ALDH1A1KMT2AKDM4ELMNAMAPT
SCHEMBL2984400 0.81 MAPT (0.54) ALDH1A1KMT2AKDM4ELMNAMAPT
SCHEMBL2985934 0.78 ACLY (0.48) KMT2ALMNAMAPTACLYMEN1
SCHEMBL2992281 0.77 ACLY (0.48) ALDH1A1KMT2ALMNAMAPTACLY
SCHEMBL2990833 0.75 ALDH1A1 (0.52) ALDH1A1KMT2AKDM4ELMNAMAPT
SCHEMBL2989979 0.75 GHSR (0.46) ALDH1A1KMT2ALMNAMAPTACLY
SCHEMBL2984160 0.75 GHSR (0.53) ALDH1A1KMT2ALMNAMAPTACLY
SCHEMBL2985942 0.75 GHSR (0.53) ALDH1A1KMT2ALMNAMAPTACLY
SCHEMBL2994636 0.74 ALDH1A1 (0.45) ALDH1A1KMT2AKDM4ELMNAMAPT

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-20100179168-A1 ARYL AND HETEROARYL SULPHONAMIDES AS GROWTH HORMONE SECRETAGOGUE RECEPTOR AGONISTS BLANEY EMMA LOUISE 2010-07-15 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-20100179168-A1 ARYL AND HETEROARYL SULPHONAMIDES AS GROWTH HORMONE SECRETAGOGUE RECEPTOR AGONISTS GHSR, GHRHR, GIPR ALDH1A1 2521/4885KMT2A 2218/4885KDM4E 3009/4885

“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.