SCHEMBL20003972

SCHEMBL20003972

CCCCCCCCCCCCCCCC(=O)NC(CCC(=O)NCCCCC1NC(=O)C(C(C)CC)NC(=O)C(NC(=O)C2CCCN2C(=O)C(Cc2ccccc2)NC(=O)C(Cc2c[nH]cn2)NC(=O)C(NC(=O)C(CC(=O)O)NC(=O)CC(C)C)C(C)O)CSSCC(C(=O)NC(CCCCN)C(N)=O)NC(=O)CNC(=O)C(CCCCN)NC(=O)C(CO)NC(=O)C(CCCNC(=N)N)NC(=O)C2CCCN2C(=O)C(CCC(=O)O)NC(=O)C(Cc2ccccc2)NC1=O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MC4R P32245 2/20 0.53
MC1R Q01726 2/20 0.53
MC3R P41968 1/20 0.52
TEAD1 P28347 1/20 0.52
KLK7 P49862 2/20 0.52
GLP1R P43220 6/20 0.51
GCGR P47871 2/20 0.51
NPY2R P49146 2/20 0.51
GHSR Q92847 1/20 0.51
CXCR4 P61073 3/20 0.51
EPHA2 P29317 1/20 0.51
CSNK2A2 P19784 1/20 0.50
CSNK2B P67870 1/20 0.50
CSNK2A1 P68400 1/20 0.50
CSNK2A3 Q8NEV1 1/20 0.50
RXFP4 Q8TDU9 1/20 0.49
RXFP3 Q9NSD7 1/20 0.49

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
SCHEMBL20402542 1.00 MC4R (0.53) MC4RMC1RMC3RTEAD1KLK7
SCHEMBL23056722 0.99 TEAD1 (0.53) MC4RMC1RMC3RTEAD1KLK7
SCHEMBL27014090 0.99 TEAD1 (0.53) MC4RMC1RMC3RTEAD1KLK7
SCHEMBL20003971 0.98 GLP1R (0.51) MC4RMC1RMC3RTEAD1KLK7
SCHEMBL20003981 0.97 MC4R (0.50) MC4RMC1RMC3RTEAD1KLK7
SCHEMBL23056750 0.95 GLP1R (0.51) MC4RMC1RKLK7GLP1RGCGR
SCHEMBL26952437 0.93 MC4R (0.59) MC4RMC1RMC3RTEAD1GLP1R
SCHEMBL20003753 0.91 PRLHR (0.58) GLP1RGCGRNPY2REPHA2RXFP4
SCHEMBL29393563 0.78 F11 (0.56) MC4RMC1RMC3RKLK7GLP1R
SCHEMBL24625820 0.77 KLK7 (0.53) KLK7EPHA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240016895-A1 HEPCIDIN MIMETICS FOR TREATMENT OF SICKLE CELL DISEASE PROTAGONIST THERAPEUTICS, INC. 2024-01-18 US disclosed
US-10030061-B2 Hepcidin analogues and uses thereof PROTAGONIST THERAPEUTICS, INC. (US) 2018-07-24 US disclosed
US-20180086811-A1 HEPCIDIN ANALOGUES AND USES THEREOF PROTAGONIST THERAPEUTICS, INC. 2018-03-29 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 (3 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-10030061-B2 Hepcidin analogues and uses thereof HAMP, SLC40A1, FTH1 MC4R 917/4885MC1R 281/4885MC3R 976/4885
US-20240016895-A1 HEPCIDIN MIMETICS FOR TREATMENT OF SICKLE CELL DISEASE HAMP, HBG1, HBG2 MC4R 1409/4885MC1R 487/4885MC3R 1549/4885
US-20180086811-A1 HEPCIDIN ANALOGUES AND USES THEREOF HAMP, SLC40A1, FTH1 MC4R 925/4885MC1R 282/4885MC3R 972/4885

“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.