SCHEMBL26752802

SCHEMBL26752802

CCN(CC)CC(=O)N(c1c(C)cccc1C)C(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
LMNA P02545 3/20 0.53
MAPT P10636 3/20 0.53
CYP3A4 P08684 2/20 0.53
MAPK1 P28482 1/20 0.53
MC4R P32245 1/20 0.53
SCN4A P35499 1/20 0.53
MC3R P41968 1/20 0.53
HTR3A P46098 1/20 0.53
SCN5A Q14524 1/20 0.53
SCN9A Q15858 1/20 0.53
SCN3A Q9NY46 1/20 0.53
GAA P10253 1/20 0.51
BLM P54132 1/20 0.51
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
RORC P51449 1/20 0.40
KDM4E B2RXH2 1/20 0.39
AGTR1 P30556 1/20 0.39
NPSR1 Q6W5P4 2/20 0.39

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
SCHEMBL11146150 0.84 NPSR1 (0.55) ALDH1A1LMNAMAPTCYP3A4MAPK1
SCHEMBL17471510 0.83 ALDH1A1 (0.53) ALDH1A1LMNAMAPTCYP3A4MAPK1
SCHEMBL26029432 0.81 TP53 (0.42) ALDH1A1LMNAMAPTCYP3A4MAPK1
SCHEMBL11925057 0.79 ALDH1A1 (0.49) ALDH1A1LMNAMAPTCYP3A4MAPK1
SCHEMBL26002689 0.79 SMN1; SMN2 (0.42) ALDH1A1LMNAMAPTCYP3A4GAA
SCHEMBL28854779 0.78 ALDH1A1 (0.48) ALDH1A1LMNAMAPTCYP3A4MAPK1
SCHEMBL1108457 0.76 MEN1 (0.43) ALDH1A1LMNAMAPTCYP3A4GAA
SCHEMBL26002722 0.76 P2RX7 (0.45) ALDH1A1LMNAMAPTCYP3A4TP53
SCHEMBL13472597 0.75 TRPM8 (0.56) ALDH1A1LMNAMAPTGAATP53
SCHEMBL11543584 0.74 NPSR1 (0.52) ALDH1A1LMNAMAPTCYP3A4MAPK1

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-20230346942-A1 MACROMOLECULAR PRODRUGS FOR LIGHT-EMITTING DIODES AND USES THEREOF CHILDREN'S MEDICAL CENTER CORPORATION (US) 2023-11-02 US disclosed
US-20230346942-A1 MACROMOLECULAR PRODRUGS FOR LIGHT-EMITTING DIODES AND USES THEREOF CHILDREN'S MEDICAL CENTER CORPORATION (US) 2023-11-02 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-20230346942-A1 MACROMOLECULAR PRODRUGS FOR LIGHT-EMITTING DIODES AND USES THEREOF CRY1, MAPT, PYGL ALDH1A1 650/4885LMNA 699/4885MAPT 2/4885

“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.