SCHEMBL25844752

SCHEMBL25844752

CC(C)CCCCN1CCCC(C)C1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 14/20 0.49
KDM4E B2RXH2 1/20 0.46
HTR7 P34969 2/20 0.45
MAOB P27338 1/20 0.45

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
SCHEMBL761884 0.95 KDM4E (0.47) HRH3KDM4EHTR7MAOB
SCHEMBL12449634 0.87 KDM4E (0.50) HRH3KDM4EHTR7
SCHEMBL13077 0.87 KDM4E (0.50) HRH3KDM4EHTR7
SCHEMBL13995508 0.87 KDM4E (0.50) HRH3KDM4EHTR7
SCHEMBL7771642 0.86 KDM4E (0.47) HRH3KDM4EHTR7MAOB
SCHEMBL9374424 0.85 HRH3 (0.53) HRH3KDM4EHTR7MAOB
SCHEMBL17574727 0.83 SIGMAR1 (0.47) HRH3KDM4E
SCHEMBL17574703 0.83 SIGMAR1 (0.47) HRH3KDM4E
SCHEMBL9322433 0.82 HRH3 (0.41) HRH3KDM4EHTR7MAOB
SCHEMBL12513823 0.81 BCHE (0.55) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4272825-A2 MTORC MODULATORS AND USES THEREOF Aeovian Pharmaceuticals, Inc. (US) 2023-11-08 EP disclosed
US-11702429-B2 mTORC modulators and uses thereof AEOVIAN PHARMACEUTICALS, INC. (US) 2023-07-18 US disclosed
US-20170114053-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERV (US) 2017-04-27 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 (2 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-11702429-B2 mTORC modulators and uses thereof MTOR, RICTOR, RPTOR HRH3 3363/4885KDM4E 1617/4885HTR7 3702/4885
US-20170114053-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF HAVCR2, AR, AKR7A2 HRH3 859/4885KDM4E 2363/4885HTR7 1545/4885

“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.