SCHEMBL21698745

SCHEMBL21698745

C=C(CC)CCCCN(C)C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
DNM1 Q05193 5/20 0.44
KDM4A O75164 11/20 0.37
KDM4C Q9H3R0 11/20 0.37
KDM5A P29375 1/20 0.37
KDM7A Q6ZMT4 1/20 0.37
PHF8 Q9UPP1 1/20 0.37
KDM2A Q9Y2K7 1/20 0.37
PAOX Q6QHF9 1/20 0.34
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL21698588 0.93 ALDH1A1 (0.41) ALDH1A1TSHRDNM1KDM4AKDM4C
SCHEMBL23655783 0.82
SCHEMBL23656237 0.79 PAOX (0.39) ALDH1A1KDM4CKDM5APAOX
SCHEMBL23761749 0.79
SCHEMBL21937171 0.78 LSS (0.49) ALDH1A1TSHRDNM1KDM4AKDM4C
SCHEMBL23011695 0.78 LSS (0.49) ALDH1A1TSHRDNM1KDM4AKDM4C
SCHEMBL21308452 0.77
SCHEMBL19085564 0.76 DNM1 (0.44) ALDH1A1TSHRDNM1PAOX
SCHEMBL1615108 0.76 ALDH1A1 (0.46) ALDH1A1TSHRDNM1KDM4AKDM4C
SCHEMBL25668342 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230331803-A1 CO-AGONISTS OF THE GLP-1 AND AMYLIN RECEPTORS NOVO NORDISK A/S (DK) 2023-10-19 US disclosed
EP-3608308-B1 LIPIDS AND LIPID COMPOSITIONS FOR THE DELIVERY OF ACTIVE AGENTS NOVARTIS AG (CH) 2021-07-21 EP disclosed
EP-3608308-A1 LIPIDS AND LIPID COMPOSITIONS FOR THE DELIVERY OF ACTIVE AGENTS Novartis AG (CH) 2020-02-12 EP 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-20230331803-A1 CO-AGONISTS OF THE GLP-1 AND AMYLIN RECEPTORS GLP1R, GIPR, GCGR ALDH1A1 3429/4885TSHR 202/4885DNM1 1174/4885

“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.