SCHEMBL30875239

SCHEMBL30875239

Cc1nc(B2OC(C)(C)C(C)(C)O2)cn1CCCCCCNC(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
DRD2 P14416 6/20 0.41
BRD4 O60885 4/20 0.40
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
STK17B O94768 1/20 0.38
STK17A Q9UEE5 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL27091119 0.86 FAAH (0.33)
SCHEMBL30875242 0.79 TDP1 (0.48) TDP1DRD2BRD4STK17BSTK17A
SCHEMBL30875416 0.78 FFAR1 (0.50) TDP1DRD2PRMT5WDR77CYP3A4
SCHEMBL12435875 0.78 FFAR1 (0.50) TDP1DRD2PRMT5WDR77CYP3A4
SCHEMBL30875345 0.75 TDP1 (0.41) TDP1DRD2BRD4PRMT5WDR77
SCHEMBL30875430 0.74 DRD2 (0.39) TDP1DRD2BRD4PRMT5WDR77
SCHEMBL25433571 0.73 PRMT5 (0.47) DRD2PRMT5WDR77
SCHEMBL2878564 0.73 DRD2 (0.42) TDP1DRD2BRD4STK17BSTK17A
SCHEMBL16169728 0.73 FFAR1 (0.52) TDP1DRD2PRMT5WDR77STK17B
SCHEMBL21069375 0.73 STK17B (0.44) TDP1DRD2BRD4STK17BSTK17A

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-20240050428-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI), INC. (CN) 2024-02-15 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-20240050428-A1 COMPOUNDS AND METHODS OF TREATING CANCERS GSPT1, GGT1, VHL TDP1 246/4885DRD2 4688/4885BRD4 502/4885

“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.