SCHEMBL1709682

SCHEMBL1709682

CCN(CC)CCCS(=O)(=O)N[C@H](CCc1ccccc1)c1nc(CNC2CCCC2)n[nH]1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 5/20 0.62
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CCR4 P51679 1/20 0.34
FABP6 P51161 1/20 0.32
CACNA2D1 P54289 1/20 0.32
OPRM1 P35372 3/20 0.32
OPRK1 P41145 1/20 0.32
GAA P10253 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
CHRM2 P08172 2/20 0.31
HTR1A P08908 2/20 0.31
ADRA2A P08913 2/20 0.31
CHRM1 P11229 2/20 0.31

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
SCHEMBL1709719 0.99 GHSR (0.61) GHSRCYP3A4TSHRKDM4EALDH1A1
SCHEMBL1709717 0.89 GHSR (0.57) GHSRTSHRTP53HPGDOPRM1
SCHEMBL1709615 0.88 GHSR (0.61) GHSRCYP3A4TSHRKDM4EALDH1A1
SCHEMBL10121679 0.88 GHSR (0.57) GHSRTSHRTP53HPGDOPRM1
SCHEMBL10121964 0.87 GHSR (0.69) GHSRCYP3A4TSHRKDM4EALDH1A1
SCHEMBL1709690 0.87 GHSR (0.59) GHSRCYP3A4TSHRALDH1A1CCR4
SCHEMBL1709684 0.87 GHSR (0.62) GHSRTSHRALDH1A1CCR4CACNA2D1
SCHEMBL1709649 0.86 GHSR (0.68) GHSRCYP3A4KDM4EALDH1A1HPGD
SCHEMBL1709548 0.86 GHSR (0.58) GHSRCYP3A4TSHRCCR4OPRM1
SCHEMBL10122192 0.86 GHSR (0.57) GHSRCYP3A4TSHRALDH1A1CCR4

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 1/4885CYP3A4 3685/4885TSHR 27/4885

“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.