SCHEMBL10122136

SCHEMBL10122136

CCN(CC)CCCS(=O)(=O)N[C@H](Cc1ccccc1)c1nc(CN(C)C(=O)NC(C)C)n(C)n1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.39
LMNA P02545 1/20 0.35
TACR2 P21452 4/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
CA2 P00918 1/20 0.32
PSMB1 P20618 1/20 0.32
PSMB5 P28074 1/20 0.32
PSMB2 P49721 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
GPR55 Q9Y2T6 1/20 0.31
ATM Q13315 1/20 0.31
GAA P10253 1/20 0.31
PTGES O14684 2/20 0.30
CYP2D6 P10635 1/20 0.30
DUT P33316 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
SCHEMBL1709572 0.92 GHSR (0.46) GHSRLMNABCHEACHEHDAC1
SCHEMBL1709739 0.86 GHSR (0.45) GHSRLMNABCHEACHEHDAC1
SCHEMBL1709725 0.86 HDAC1 (0.41) GHSRLMNAHDAC1HDAC6
SCHEMBL10121974 0.84 GHSR (0.46) GHSRLMNABCHEACHEHDAC1
SCHEMBL10122293 0.84 GHSR (0.41) GHSRLMNAHDAC1HDAC6GPR55
SCHEMBL10122141 0.84 GHSR (0.45) GHSRLMNABCHEACHEGAA
SCHEMBL1709722 0.83 GHSR (0.45) GHSRLMNABCHEACHEHDAC1
SCHEMBL1709740 0.82 GHSR (0.45) GHSRLMNABCHEACHEHDAC1
SCHEMBL10122210 0.82 GHSR (0.46) GHSRLMNABCHEACHECA2
SCHEMBL10122142 0.81 CCR5 (0.41) GHSRLMNAATM

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-20120088747-A1 SULFONAMIDE CONTAINING COMPOUNDS AND USES THEREOF ELIXIR PHARMACEUTICALS, INC. 2012-04-12 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-20120088747-A1 SULFONAMIDE CONTAINING COMPOUNDS AND USES THEREOF GHSR, GHRHR, STS GHSR 1/4885LMNA 3245/4885TACR2 479/4885

“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.