SCHEMBL22045458

SCHEMBL22045458

CC(C)CP(=O)(NC(C)C)NC(C)C

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
BCHE P06276 1/20 0.42
HIF1A Q16665 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.34
MMP1 P03956 1/20 0.30
MMP8 P22894 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
SCHEMBL22388992 0.85 ALDH1A1 (0.36) ALDH1A1BCHEHIF1ATRPM8
SCHEMBL24067438 0.74 TRPM8 (0.43) ALDH1A1BCHEHIF1ATRPM8
SCHEMBL21787980 0.74 ALDH1A1 (0.39) ALDH1A1BCHEHIF1ATRPM8MMP1
SCHEMBL8817046 0.74 ALDH1A1 (0.39) ALDH1A1BCHEHIF1ATRPM8
SCHEMBL24015444 0.72 ALDH1A1 (0.42) ALDH1A1BCHEHIF1A
SCHEMBL14600549 0.72 ALDH1A1 (0.42) ALDH1A1BCHEHIF1A
SCHEMBL24872350 0.70 TRPM8 (0.38) TRPM8
SCHEMBL24065129 0.70 ALDH1A1 (0.40) ALDH1A1BCHEHIF1ATRPM8
SCHEMBL20813385 0.69 ALDH1A1 (0.39) ALDH1A1BCHEHIF1A
SCHEMBL576093 0.65 TRPM8 (0.55) TRPM8MMP1MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873281-B2 Conjugates of cell binding molecules with cytotoxic agents HANGZHOU DAC BIOTECH CO., LTD. (CN) 2024-01-16 US disclosed
US-20210346523-A1 SPECIFIC CONJUGATION LINKERS, SPECIFIC IMMUNOCONJUGATES THEREOF, METHODS OF MAKING AND USES SUCH CONJUGATES THEREOF HANGZHOU DAC BIOTECH CO., LTD. (CN) 2021-11-11 US disclosed
US-20210308277-A1 CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LINKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2021-10-07 US disclosed
US-20200172480-A1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2020-06-04 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 (4 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-11873281-B2 Conjugates of cell binding molecules with cytotoxic agents CD4, CD2, CD47 ALDH1A1 3075/4885BCHE 1976/4885HIF1A 4221/4885
US-20200172480-A1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS CD4, CD2, CD47 ALDH1A1 3075/4885BCHE 1976/4885HIF1A 4221/4885
US-20210308277-A1 CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LINKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS CD2BP2, DCLRE1A, EPCAM ALDH1A1 618/4885BCHE 2629/4885HIF1A 4489/4885
US-20210346523-A1 SPECIFIC CONJUGATION LINKERS, SPECIFIC IMMUNOCONJUGATES THEREOF, METHODS OF MAKING AND USES SUCH CONJUGATES THEREOF SLC25A1, GCDH, FH ALDH1A1 743/4885BCHE 1261/4885HIF1A 2608/4885

“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.