SCHEMBL26329904

SCHEMBL26329904

CCc1cc(OC)c2cc(N3CC4CCC(C3)O4)ccc2n1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MTOR P42345 5/20 0.39
BRD4 O60885 1/20 0.38
NTSR1 P30989 11/20 0.38
GAK O14976 1/20 0.35
DPP4 P27487 2/20 0.34

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
SCHEMBL23999579 0.85 TSHR (0.45) MTORBRD4NTSR1GAK
SCHEMBL26329960 0.81 ALDH1A1 (0.47) NTSR1
SCHEMBL26329876 0.80 LRRK2 (0.39) NTSR1GAK
SCHEMBL26318011 0.80 DOT1L (0.40) MTORBRD4NTSR1GAKDPP4
SCHEMBL26329889 0.77 GAK (0.38) GAK
SCHEMBL24004017 0.71 TSHR (0.60) GAK
SCHEMBL23133586 0.71 PRMT5 (0.42) MTOR
SCHEMBL26317976 0.70 TSHR (0.50) NTSR1GAK
SCHEMBL26317683 0.69 PDE10A (0.53) GAK
SCHEMBL25490846 0.69 IP6K1 (0.37) MTORGAK

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-20230295114-A1 AKT3 MODULATORS Georgiamune Inc. 2023-09-21 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-20230295114-A1 AKT3 MODULATORS AKT3, AKT2, MTOR MTOR 3/4885BRD4 3048/4885NTSR1 4534/4885

“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.