SCHEMBL29307669

SCHEMBL29307669

CCC(C)(C)COCCN1CCCCCCC1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 16/20 0.44
MAOB P27338 8/20 0.44
PSMB1 P20618 2/20 0.41
PSMB5 P28074 2/20 0.41
PSMB2 P49721 2/20 0.41

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
SCHEMBL21941329 0.98 HRH3 (0.43) HRH3MAOBPSMB1PSMB5PSMB2
SCHEMBL21667940 0.84 KDM4E (0.40) HRH3MAOBPSMB1PSMB5PSMB2
SCHEMBL20332900 0.84 HRH3 (0.43) HRH3MAOBPSMB1PSMB5PSMB2
SCHEMBL31617090 0.82 HRH3 (0.39) HRH3MAOB
SCHEMBL31617064 0.82 HRH3 (0.39) HRH3MAOB
SCHEMBL18650122 0.82 PSMB1 (0.45) HRH3MAOBPSMB1PSMB5PSMB2
SCHEMBL21348351 0.81 HRH3 (0.42) HRH3MAOB
SCHEMBL21667967 0.81 LTA4H (0.43) HRH3MAOB
SCHEMBL10223194 0.80 KDM4E (0.43) HRH3MAOBPSMB1PSMB5PSMB2
SCHEMBL21667821 0.80 LTA4H (0.45) HRH3MAOB

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-12036319-B2 Polyvalent sting activating compositions and uses thereof THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-07-16 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-12036319-B2 Polyvalent sting activating compositions and uses thereof STING1, CGAS, TLR7 HRH3 2151/4885MAOB 4818/4885PSMB1 1225/4885

“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.