SCHEMBL24966005

SCHEMBL24966005

CC(C)[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N1CCCC1)N(C)C(=O)C(C)(Cc1ccccc1)NC(=O)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 3/20 0.36
CCKBR P32239 3/20 0.36
CASP3 P42574 2/20 0.35
TACR3 P29371 1/20 0.35
CTSB P07858 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
KMT2A Q03164 1/20 0.34
FPR2 P25090 2/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
CASP8 Q14790 1/20 0.33
EED O75530 1/20 0.33
ELANE P08246 1/20 0.33
CTSG P08311 1/20 0.33

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
SCHEMBL24966006 1.00 CMA1 (0.36) CMA1CCKBRCASP3TACR3CTSB
SCHEMBL24965199 0.97 CMA1 (0.35) CMA1CCKBRCASP3TACR3CTSB
SCHEMBL24964936 0.88 RRM1 (0.37) ELANE
SCHEMBL24964939 0.88 RRM1 (0.37) ELANE
SCHEMBL24965922 0.86 RRM1 (0.35)
SCHEMBL24965921 0.86 RRM1 (0.35)
SCHEMBL24966026 0.86 MMP13 (0.34) CMA1CCKBRCASP3CTSBCTSS
SCHEMBL24966028 0.86 MMP13 (0.34) CMA1CCKBRCASP3CTSBCTSS
SCHEMBL24963342 0.85 RRM1 (0.34)
SCHEMBL24965154 0.84 RRM1 (0.36)

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-20230026641-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND COMPRISING HIGHLY STERICALLY HINDERED AMINO ACID CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-01-26 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-20230026641-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND COMPRISING HIGHLY STERICALLY HINDERED AMINO ACID DNPEP, VIP, NPEPPS CMA1 1810/4885CCKBR 196/4885CASP3 1864/4885

“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.