SCHEMBL25075314

SCHEMBL25075314

CC(C)C[C@H]1CCN(CCC(=O)N2CCC(C(C)C)CC2)C1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
GNAI3 P08754 5/20 0.39
GNAO1 P09471 5/20 0.39
GNAI1 P63096 5/20 0.39
HSD11B1 P28845 1/20 0.35
POLB P06746 2/20 0.35
HTT P42858 1/20 0.35
ITGB3 P05106 1/20 0.34
ITGA2B P08514 1/20 0.34
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
SMYD3 Q9H7B4 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL25075131 1.00 NPC1 (0.39) NPC1GNAI3GNAO1GNAI1HSD11B1
SCHEMBL26494156 1.00 NPC1 (0.39) NPC1GNAI3GNAO1GNAI1HSD11B1
SCHEMBL26494158 0.92 NPC1 (0.43) NPC1GNAI3GNAO1GNAI1HSD11B1
SCHEMBL25075138 0.92 NPC1 (0.43) NPC1GNAI3GNAO1GNAI1HSD11B1
SCHEMBL26494363 0.92 NPC1 (0.43) NPC1GNAI3GNAO1GNAI1HSD11B1
SCHEMBL25075447 0.92 NPC1 (0.41) NPC1GNAI3GNAO1GNAI1HSD11B1
SCHEMBL26494190 0.92 NPC1 (0.41) NPC1GNAI3GNAO1GNAI1HSD11B1
SCHEMBL25075134 0.91 NPC1 (0.40) NPC1GNAI3GNAO1GNAI1HSD11B1
SCHEMBL25075121 0.86 BIRC2 (0.38) NPC1GNAI3GNAO1GNAI1ALDH1A1
SCHEMBL25075104 0.86 BIRC2 (0.38) NPC1GNAI3GNAO1GNAI1ALDH1A1

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-20230137175-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BRUTON'S TYROSINE KINASE ENDOTARGET INC. 2023-05-04 US disclosed
WO-2023023537-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BRUTON'S TYROSINE KINASE ENDOTARGET INC. (US) 2023-02-23 WO 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-20230137175-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BRUTON'S TYROSINE KINASE BTK, BCL9, CRBN NPC1 4398/4885GNAI3 1728/4885GNAO1 3018/4885

“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.