SCHEMBL25512781

SCHEMBL25512781

CCCOCCOCCOCCOCCOCCOCCN1CCN(CCCC(C)C)CC1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.37
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 1/20 0.36
GBA1 P04062 2/20 0.35
GNAI3 P08754 1/20 0.34
GNAO1 P09471 1/20 0.34
GNAI1 P63096 1/20 0.34
MAPT P10636 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
TP53 P04637 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HRH2 P25021 1/20 0.33
HRH1 P35367 1/20 0.33
USP2 O75604 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
SCHEMBL25118180 0.91 HRH2 (0.38) HTTKDM4EALDH1A1GBA1GNAI3
SCHEMBL22963141 0.89 KDM4E (0.37) HTTKDM4EALDH1A1GBA1TP53
SCHEMBL20850751 0.89 KDM4E (0.37) HTTKDM4EALDH1A1GBA1TP53
SCHEMBL22169658 0.89 HTT (0.35) HTTKDM4EALDH1A1GNAI3GNAO1
SCHEMBL24673304 0.86 HRH3 (0.35) HTTGBA1GNAI3GNAO1GNAI1
SCHEMBL22963144 0.84 GBA1 (0.38) HTTKDM4EALDH1A1GBA1TP53
SCHEMBL25518503 0.83 USP2 (0.33) HTTKDM4EALDH1A1GBA1GNAI3
SCHEMBL21449107 0.83 GNAI3 (0.44) HTTKDM4EALDH1A1GNAI3GNAO1
SCHEMBL22848922 0.82 MAPK1 (0.39) HTTKDM4EALDH1A1GBA1TP53
SCHEMBL24847753 0.82 ALDH1A1 (0.45) HTTKDM4EALDH1A1GBA1USP2

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-20230148436-A2 NOVEL SMALL MOLECULE IMMUNE AGONISTS AND IMMUNE TARGETING COMPOUNDS AND APPLICATION THEREOF SHENZHEN UNIVERSITY (CN) 2023-05-11 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-20230148436-A2 NOVEL SMALL MOLECULE IMMUNE AGONISTS AND IMMUNE TARGETING COMPOUNDS AND APPLICATION THEREOF IFNG, IFNAR1, STING1 HTT 4539/4885KDM4E 4615/4885ALDH1A1 4334/4885

“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.