SCHEMBL23071807

SCHEMBL23071807

CC(C)C(NC(=O)CCOCCOCCN)C(=O)N[C@@H](C)C(=O)NCCN

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PGA5 P0DJD9 2/20 0.36
CHRNA1 P02708 1/20 0.35
CHRNG P07510 1/20 0.35
CHRNB1 P11230 1/20 0.35
CHRND Q07001 1/20 0.35

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
SCHEMBL23071888 0.89 FURIN (0.34) PGA5
SCHEMBL23433104 0.87 PGA5 (0.34) PGA5
SCHEMBL23071806 0.87 CASP1 (0.32) MEN1KMT2APGA5
SCHEMBL23071949 0.87 PGA5 (0.38) PGA5
SCHEMBL23432993 0.87 PGA5 (0.38) PGA5
SCHEMBL23071874 0.86 SDCBP (0.37)
SCHEMBL23432984 0.85 PGA5 (0.38) PGA5
SCHEMBL23432985 0.85 PGA5 (0.38) PGA5
SCHEMBL30748708 0.84 SDCBP (0.34) MEN1KMT2ACHRNA1CHRNGCHRNB1
SCHEMBL23071799 0.83 NMT2 (0.45)

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-20210163458-A1 NOVEL CRYPTOPHYCIN COMPOUNDS AND CONJUGATES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANOFI SA (FR) 2021-06-03 US disclosed
US-10941139-B2 Cryptophycin compounds and conjugates, their preparation and their therapeutic use SANOFI (FR) 2021-03-09 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-20210163458-A1 NOVEL CRYPTOPHYCIN COMPOUNDS AND CONJUGATES, THEIR PREPARATION AND THEIR THERAPEUTIC USE XPOT, HCCS, COIL MEN1 105/4885KMT2A 3106/4885PGA5 4061/4885
US-10941139-B2 Cryptophycin compounds and conjugates, their preparation and their therapeutic use XPOT, COIL, HCCS MEN1 35/4885KMT2A 2771/4885PGA5 3703/4885

“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.