SCHEMBL17449732

SCHEMBL17449732

NC(C=O)CSSC[C@H](N)C=O

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
THPO P40225 1/20 0.32
GMNN O75496 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PMP22 Q01453 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 1/20 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
SCHEMBL12851469 1.00 CYP3A4 (0.32) CYP3A4CYP2D6TSHRNFKB1THPO
SCHEMBL5137869 1.00 CYP3A4 (0.32) CYP3A4CYP2D6TSHRNFKB1THPO
SCHEMBL10331496 0.85 TRPA1 (0.50) CYP3A4SMN1; SMN2
SCHEMBL21067332 0.83 TSHR (0.31) TSHRSMN1; SMN2
SCHEMBL23627794 0.82 ARG1 (0.40) PMP22
SCHEMBL4782837 0.82 ARG1 (0.40) PMP22
SCHEMBL15024999 0.82 ARG1 (0.40) PMP22
SCHEMBL20431198 0.80
SCHEMBL24295875 0.80 NOS2 (0.32)
SCHEMBL41166 0.79

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11702448-B2 Method of treating melanocortin-4 receptor-associated disorders in heterozygous carriers RHYTHM PHARMACEUTICALS, INC. (US) 2023-07-18 US disclosed
US-20160017001-A1 PEPTIDE COMPOSITIONS RHYTHM PHARMACEUTICALS, INC. 2016-01-21 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 (2 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-11702448-B2 Method of treating melanocortin-4 receptor-associated disorders in heterozygous carriers MC4R, MC1R, MC2R CYP3A4 4244/4885CYP2D6 4350/4885TSHR 151/4885
US-20160017001-A1 PEPTIDE COMPOSITIONS MC4R, MC3R, MC5R CYP3A4 2889/4885CYP2D6 3486/4885TSHR 70/4885

“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.