SCHEMBL24926102

SCHEMBL24926102

C=CC1(C(C)(C)C)CCN(C(=O)CCCN2CCN(C(C)(C)C)CC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.34
HTR1A P08908 4/20 0.34
HTR7 P34969 1/20 0.34
NPC1 O15118 2/20 0.32
RAB9A P51151 1/20 0.32
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
ATM Q13315 1/20 0.31
DRD2 P14416 6/20 0.31
DRD3 P35462 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
DRD4 P21917 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL23594104 0.82 HTR7 (0.36) SIGMAR1HTR1AHTR7NPC1PDCD1
SCHEMBL24926155 0.82 HTR7 (0.38) SIGMAR1HTR1AHTR7NPC1PDCD1
SCHEMBL26827171 0.80 HTR1A (0.35) SIGMAR1HTR1AHTR7NPC1PDCD1
SCHEMBL24926663 0.80 PDCD1 (0.41) SIGMAR1HTR1AHTR7NPC1PDCD1
SCHEMBL26827161 0.80 HTR7 (0.36) SIGMAR1HTR1AHTR7NPC1PDCD1
SCHEMBL24926264 0.78 HTR7 (0.35) SIGMAR1HTR1AHTR7NPC1PDCD1
SCHEMBL26804172 0.78 HTR1A (0.35) SIGMAR1HTR1AHTR7NPC1PDCD1
SCHEMBL26810946 0.70 HSD11B1 (0.43) SIGMAR1HTR1AHTR7NPC1PDCD1
SCHEMBL16219507 0.69 MAPK1 (0.58) DRD2DRD4MEN1KMT2A
SCHEMBL16219392 0.69 PAOX (0.58) SIGMAR1HTR1A

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-20230029378-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING BTK VIA UBIQUITIN PROTEOSOME PATHWAY NURIX THERAPEUTICS, INC. 2023-01-26 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-20230029378-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING BTK VIA UBIQUITIN PROTEOSOME PATHWAY CBL, XIAP, BTK SIGMAR1 4492/4885HTR1A 4414/4885HTR7 4505/4885

“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.