SCHEMBL25567948

SCHEMBL25567948

CC(C)CCN1CCCN(C(C)C)CC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.43
HTR7 P34969 1/20 0.43
HRH3 Q9Y5N1 2/20 0.38
DAO P14920 1/20 0.38
POLB P06746 1/20 0.38
MAOB P27338 4/20 0.37
KDM1A O60341 1/20 0.37
FPR3 P25089 1/20 0.35
FPR2 P25090 1/20 0.35

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
SCHEMBL13519629 0.92 DAO (0.42) SIGMAR1HTR7HRH3DAOMAOB
SCHEMBL23384009 0.85 HTR7 (0.49) SIGMAR1HTR7HRH3DAOPOLB
SCHEMBL13860742 0.85 HTR7 (0.48) SIGMAR1HTR7HRH3DAOPOLB
SCHEMBL441047 0.85
SCHEMBL23384522 0.83 HTR7 (0.48) SIGMAR1HTR7HRH3DAOPOLB
SCHEMBL16750031 0.82 SIGMAR1 (0.44) SIGMAR1HTR7HRH3DAOPOLB
SCHEMBL21477202 0.81 CHRM5 (0.39) SIGMAR1HTR7HRH3FPR3FPR2
SCHEMBL732901 0.81 DAO (0.47) SIGMAR1HTR7HRH3DAOPOLB
SCHEMBL172560 0.80 CARM1 (0.44) HRH3
SCHEMBL12205471 0.80 SIGMAR1 (0.46) SIGMAR1HTR7HRH3DAOPOLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230167105-A1 BCL-2 PROTEIN INHIBITORS RECURIUM IP HOLDINGS, LLC 2023-06-01 US disclosed
US-20230167105-A1 BCL-2 PROTEIN INHIBITORS RECURIUM IP HOLDINGS, LLC 2023-06-01 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-20230167105-A1 BCL-2 PROTEIN INHIBITORS BCL2, BCL2L1, BCL2L2 SIGMAR1 4371/4885HTR7 4150/4885HRH3 4745/4885

“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.