SCHEMBL25670360

SCHEMBL25670360

COC(=O)C1CCN(C(C)CCC(C)N2CCCC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.48
SMN1; SMN2 Q16637 5/20 0.47
TP53 P04637 1/20 0.46
ALDH1A1 P00352 6/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 2/20 0.39
HTT P42858 1/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL17789645 0.80 SMN1; SMN2 (0.54) GAASMN1; SMN2TP53ALDH1A1POLB
SCHEMBL4432834 0.79 TP53 (0.55) GAASMN1; SMN2TP53ALDH1A1POLB
SCHEMBL25831427 0.77 GAA (0.44) GAASMN1; SMN2TP53ALDH1A1POLB
SCHEMBL10232853 0.76 TP53 (0.47) GAASMN1; SMN2TP53ALDH1A1POLB
SCHEMBL27000160 0.75 SMN1; SMN2 (0.42) GAASMN1; SMN2TP53ALDH1A1HTT
SCHEMBL10017888 0.73 KDM2B (0.50) SMN1; SMN2TP53ALDH1A1POLB
SCHEMBL13676337 0.73 KDM2B (0.50) SMN1; SMN2TP53ALDH1A1POLB
SCHEMBL10017896 0.73 KDM2B (0.50) SMN1; SMN2TP53ALDH1A1POLB
SCHEMBL20205996 0.73 MAPT (0.56) GAASMN1; SMN2ALDH1A1MAPTKDM4E
SCHEMBL2433692 0.73 SMN1; SMN2 (0.43) GAASMN1; SMN2TP53ALDH1A1POLB

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-20230174506-A1 (DI)AMINATION OF ACTIVATED ALLENE COMPOUNDS, DERIVATIVES THEREOF, AND METHODS FOR SYNTHESIS OF THE SAME PURDUE RESEARCH FOUNDATION 2023-06-08 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-20230174506-A1 (DI)AMINATION OF ACTIVATED ALLENE COMPOUNDS, DERIVATIVES THEREOF, AND METHODS FOR SYNTHESIS OF THE SAME NAAA, PAM, AANAT GAA 2109/4885SMN1; SMN2 4030/4885TP53 4206/4885

“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.