SCHEMBL22472732

SCHEMBL22472732

CC(C)C(C)(C)N1C(=O)CC(C(C)(C)C)C1=O

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.34
MT-CO2 P00403 1/20 0.30
ALOX5 P09917 1/20 0.30

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
SCHEMBL1753618 0.82 MT-CO2 (0.33) MT-CO2ALOX5
SCHEMBL20228114 0.82 MT-CO2 (0.33) MT-CO2ALOX5
SCHEMBL23839856 0.78 MT-CO2 (0.31) MT-CO2ALOX5
SCHEMBL20215129 0.78 MT-CO2 (0.31) MT-CO2ALOX5
SCHEMBL19360073 0.77 PIK3CD (0.38) PIK3CD
SCHEMBL21984606 0.77 ADAM17 (0.35) PIK3CD
SCHEMBL14962670 0.74 MAPT (0.39) MT-CO2ALOX5
SCHEMBL19134327 0.74 ALDH1A1 (0.30)
SCHEMBL22472710 0.73 LMNA (0.44) PIK3CD
SCHEMBL15498412 0.73

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-10787480-B2 Cytotoxic peptides and conjugates thereof NOVARTIS AG (CH) 2020-09-29 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 (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-10787480-B2 Cytotoxic peptides and conjugates thereof CD47, NGLY1, VIP PIK3CD 2987/4885MT-CO2 4608/4885ALOX5 4056/4885

“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.