SCHEMBL1709674

SCHEMBL1709674

CCN(CC)CCCS(=O)(=O)N[C@H](CCc1ccccc1)c1nc(CNC(=O)c2ccc(F)cc2)n[nH]1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.42
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
BCHE P06276 6/20 0.39
ALDH1A1 P00352 1/20 0.38
CXCR4 P61073 1/20 0.37
HTR2C P28335 1/20 0.37
MCHR1 Q99705 1/20 0.37
ACKR3 P25106 1/20 0.37
TMEM97 Q5BJF2 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
OPRM1 P35372 1/20 0.37
OPRK1 P41145 1/20 0.37
RORC P51449 1/20 0.36
POLB P06746 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
SCHEMBL1709549 0.94 GHSR (0.65) GHSRL3MBTL1ALDH1A1OPRM1OPRK1
SCHEMBL1709683 0.92 GHSR (0.59) GHSRL3MBTL1ALDH1A1OPRM1OPRK1
SCHEMBL1709547 0.91 GHSR (0.75) GHSRNPC1RAB9ABCHEALDH1A1
SCHEMBL1709689 0.89 GHSR (0.57) GHSRL3MBTL1NPC1RAB9ARORC
SCHEMBL10122103 0.88 GHSR (0.65) GHSRL3MBTL1ALDH1A1OPRM1
SCHEMBL1709652 0.88 GHSR (0.57) GHSRL3MBTL1ALDH1A1POLB
SCHEMBL10121682 0.87 GHSR (0.69) GHSRL3MBTL1OPRM1
SCHEMBL10121676 0.87 GHSR (0.64) GHSRL3MBTL1ALDH1A1OPRM1OPRK1
SCHEMBL10121950 0.87 GHSR (0.64) GHSRALDH1A1RORCPOLB
SCHEMBL1709677 0.86 GHSR (0.63) GHSRL3MBTL1RORC

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 1/4885L3MBTL1 4633/4885NPC1 1560/4885

“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.