SCHEMBL22256286

SCHEMBL22256286

CCCCC(C)CCC(S)CN

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ACE2 Q9BYF1 1/20 0.38
OPRM1 P35372 1/20 0.34
LMNA P02545 1/20 0.32
DNM1 Q05193 2/20 0.31

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
SCHEMBL12445587 0.86 TSHR (0.39) ALDH1A1TDP1
SCHEMBL2922692 0.84
SCHEMBL23776129 0.82 ACE2 (0.41) ALDH1A1TDP1ACE2OPRM1LMNA
SCHEMBL3616888 0.78 ALDH1A1 (0.48) ALDH1A1TDP1ACE2OPRM1LMNA
SCHEMBL27558484 0.78 ACE2 (0.52) ALDH1A1TDP1ACE2OPRM1LMNA
SCHEMBL18286447 0.77 ACE2 (0.43) ALDH1A1TDP1ACE2OPRM1LMNA
SCHEMBL18256105 0.77 ACE2 (0.43) ALDH1A1TDP1ACE2OPRM1LMNA
SCHEMBL25727439 0.77 ALDH1A1 (0.48) ALDH1A1TDP1ACE2OPRM1LMNA
SCHEMBL17469945 0.77 ACE2 (0.43) ALDH1A1TDP1ACE2OPRM1LMNA
SCHEMBL18085385 0.76

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-20200230133-A1 Discrete PEG Constructs EqIP, LLC (US) 2020-07-23 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-20200230133-A1 Discrete PEG Constructs MUC1, EGFR, LNPEP ALDH1A1 3743/4885TDP1 3865/4885ACE2 2849/4885

“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.