SCHEMBL25834628

SCHEMBL25834628

CCCCCCCCN1CC2(CN(C)C2)C1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 6/20 0.44
GNAO1 P09471 6/20 0.44
GNAI1 P63096 6/20 0.44
GUSB P08236 2/20 0.42
EBP Q15125 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
S1PR1 P21453 2/20 0.41
S1PR3 Q99500 2/20 0.41
S1PR5 Q9H228 2/20 0.41
S1PR4 O95977 1/20 0.41
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
GBA1 P04062 1/20 0.36

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
SCHEMBL25653853 0.89 S1PR1 (0.44) GNAI3GNAO1GNAI1GUSBEBP
SCHEMBL25144673 0.81
SCHEMBL20878487 0.79 SIGMAR1 (0.44) GNAI3GNAO1GNAI1GUSBEBP
SCHEMBL20858268 0.79 SIGMAR1 (0.44) GNAI3GNAO1GNAI1GUSBEBP
SCHEMBL26894648 0.79 GNAO1 (0.43) GNAI3GNAO1GNAI1GUSBEBP
SCHEMBL20863091 0.79 S1PR1 (0.50) GNAI3GNAO1GNAI1SIGMAR1S1PR1
SCHEMBL20892894 0.77 GUSB (0.40) GNAI3GNAO1GNAI1GUSBEBP
SCHEMBL21106970 0.77 GUSB (0.40) GNAI3GNAO1GNAI1GUSBEBP
SCHEMBL15507225 0.77 S1PR1 (0.40) GNAI3GNAO1GNAI1GUSBEBP
SCHEMBL24608207 0.76 S1PR1 (0.47) GNAI3GNAO1GNAI1SIGMAR1S1PR1

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-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 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-20230183226-A1 AKT3 MODULATORS AKT3, AKT2, MTOR GNAI3 228/4885GNAO1 1561/4885GNAI1 750/4885

“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.