SCHEMBL10121679

SCHEMBL10121679

CCN(CC)CCCS(=O)(=O)N[C@H](CCc1ccccc1)c1nc(CNC(=O)NC2CCC2)n[nH]1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 6/20 0.57
EPHX1 P07099 4/20 0.38
HPGD P15428 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
EPHX2 P34913 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
OPRM1 P35372 2/20 0.35
OPRL1 P41146 2/20 0.35
CCR5 P51681 1/20 0.35
KDM5A P29375 1/20 0.34
KMT2A Q03164 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL1709717 0.98 GHSR (0.57) GHSREPHX1HPGDNPC1RAB9A
SCHEMBL10121684 0.97 GHSR (0.59) GHSREPHX1HPGDNPC1RAB9A
SCHEMBL10121950 0.89 GHSR (0.64) GHSREPHX1EPHX2SMN1; SMN2GAA
SCHEMBL10121689 0.88 GHSR (0.61) GHSREPHX2SMN1; SMN2GAA
SCHEMBL10121851 0.88 GHSR (0.56) GHSREPHX1SMN1; SMN2GAA
SCHEMBL1709682 0.88 GHSR (0.62) GHSRHPGDTP53TSHROPRM1
SCHEMBL10121678 0.87 GHSR (0.59) GHSRRAB9ATSHROPRM1GAA
SCHEMBL1709719 0.87 GHSR (0.61) GHSRHPGDTP53TSHROPRM1
SCHEMBL1709620 0.87 GHSR (0.56) GHSRSMN1; SMN2CCR5KMT2AGAA
SCHEMBL10122191 0.87 GHSR (0.56) GHSRHPGDTSHRKMT2AGAA

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 1/4885EPHX1 2690/4885HPGD 1975/4885

“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.