SCHEMBL24079231

SCHEMBL24079231

CC(C)(C)CN1CCC(CC(C)(C)CN2CCNCC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 1/20 0.36
SIGMAR1 Q99720 1/20 0.33
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL22648508 0.90 GNAO1 (0.37) GNAO1SIGMAR1ALDH1A1HTT
SCHEMBL23765778 0.88 GNAO1 (0.36) GNAO1
SCHEMBL18745415 0.84 CHRM5 (0.32) ALDH1A1
SCHEMBL21472825 0.83 ACHE (0.39) GNAO1SIGMAR1ALDH1A1HTT
SCHEMBL18595930 0.80 CYP1A2 (0.34) ALDH1A1
SCHEMBL15706251 0.80 THRA (0.34) GNAO1
SCHEMBL1104721 0.80 SIGMAR1 (0.44) SIGMAR1ALDH1A1HTT
SCHEMBL25133415 0.79 GNAO1 (0.39) GNAO1SIGMAR1
SCHEMBL20259728 0.78 CPN1 (0.30) GNAO1
Bromide SCHEMBL4936619 0.78 SIGMAR1 (0.43) SIGMAR1ALDH1A1HTT

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-11191769-B2 Fused thiophene compounds BIOTHERYX, INC. (US) 2021-12-07 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-11191769-B2 Fused thiophene compounds SSB, ICAM1, VCAM1 GNAO1 3753/4885SIGMAR1 3758/4885ALDH1A1 3761/4885

“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.