SCHEMBL24964943

SCHEMBL24964943

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 2/20 0.37
CACNA1B Q00975 1/20 0.36
CASP3 P42574 3/20 0.35
CASP8 Q14790 2/20 0.34
CASP6 P55212 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
KMT2A Q03164 1/20 0.34
CMA1 P23946 1/20 0.34
FPR2 P25090 2/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
DPP4 P27487 1/20 0.34
ATM Q13315 1/20 0.34
CASP1 P29466 2/20 0.34
CASP7 P55210 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 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
SCHEMBL24964940 1.00 CCKBR (0.37) CCKBRCACNA1BCASP3CASP8CASP6
SCHEMBL24963334 0.87 RRM1 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL24963332 0.87 RRM1 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL24965999 0.85 RRM1 (0.36) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL24966000 0.85 RRM1 (0.36) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL24966026 0.85 MMP13 (0.34) CCKBRCASP3CASP8CASP6KMT2A
SCHEMBL24966028 0.85 MMP13 (0.34) CCKBRCASP3CASP8CASP6KMT2A
SCHEMBL24963368 0.84 RRM1 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL24963364 0.84 RRM1 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL24964913 0.84 RRM1 (0.34)

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 CCKBR 196/4885CACNA1B 2487/4885CASP3 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.