SCHEMBL19865663

SCHEMBL19865663

CCCCCCCCN1CCC(CCOC)CC1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 9/20 0.60
GNAI3 P08754 8/20 0.53
GNAI1 P63096 8/20 0.53
KCNH2 Q12809 1/20 0.50
HRH3 Q9Y5N1 2/20 0.47
HTR4 Q13639 1/20 0.44

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
SCHEMBL20231540 0.86 DRD2 (0.42) GNAO1HRH3HTR4
SCHEMBL25444591 0.84 GNAO1 (0.70) GNAO1GNAI3GNAI1KCNH2HRH3
SCHEMBL7733753 0.84 GNAO1 (0.70) GNAO1GNAI3GNAI1KCNH2HRH3
SCHEMBL25121970 0.84 GNAO1 (0.70) GNAO1GNAI3GNAI1KCNH2HRH3
SCHEMBL23767405 0.84 GNAO1 (0.74) GNAO1GNAI3GNAI1KCNH2HRH3
SCHEMBL20154540 0.83 HRH3 (0.52) GNAO1GNAI3GNAI1KCNH2HRH3
Fluoride SCHEMBL31318598 0.82 GNAO1 (0.68) GNAO1GNAI3GNAI1KCNH2HRH3
Fluoride SCHEMBL29251703 0.82 GNAO1 (0.68) GNAO1GNAI3GNAI1KCNH2HRH3
Hydrochloric Acid SCHEMBL30330489 0.82 GNAO1 (0.73) GNAO1GNAI3GNAI1KCNH2HRH3
Hydrochloric Acid SCHEMBL30330734 0.82 GNAO1 (0.73) GNAO1GNAI3GNAI1KCNH2HRH3

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-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-02-15 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-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE PDE3A, PDE2A, PDE5A GNAO1 91/4885GNAI3 158/4885GNAI1 108/4885

“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.