SCHEMBL25947360

SCHEMBL25947360

CC(C)CC(C)C(=O)OCCNCCOC(=O)C(C)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35
CA12 O43570 2/20 0.32
CA14 Q9ULX7 2/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL26043642 0.80 BIRC2 (0.35) SCN1ASCN2ASCN3ACA14CA7
SCHEMBL25947214 0.79 SCN1A (0.33) SCN1ASCN2ASCN3ACA12CA14
SCHEMBL25947159 0.76 MMP8 (0.35) SCN1ASCN2ASCN3A
SCHEMBL26418495 0.74 MEN1 (0.34)
SCHEMBL17212387 0.72 SMN1; SMN2 (0.35) CA12CA14CA7CA9
SCHEMBL14154237 0.72 CA12 (0.31) CA12CA14
SCHEMBL7223762 0.71 CA1 (0.43) CA12CA9
SCHEMBL7222777 0.71 HCAR2 (0.38)
SCHEMBL17365966 0.71 TSHR (0.37)
SCHEMBL14790215 0.71 MAPK1 (0.41)

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-20230250056-A1 PROCESS FOR SYNTHESIZING LIPIDS BRISTOL-MYERS SQUIBB COMPANY 2023-08-10 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-20230250056-A1 PROCESS FOR SYNTHESIZING LIPIDS PLIN1, SREBF1, SREBF2 SCN1A 4087/4885SCN2A 4241/4885SCN3A 4411/4885

“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.